2,2'-methyliminodiethanol
fo-4ce636a728d8173a
Identity
- Type
- NeutralMolecule
- CAS
- 105-59-9
- EC
- 203-312-7
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
30- 2,2′-(Methylimino)bis[ethanol]
- 2,2′-(Methylimino)diethanol
- 2-[(2-Hydroxyethyl)(methyl)amino]ethan-1-ol
- 2-[(2-Hydroxyethyl)(methyl)amino]ethanol
- Amietol M 12
- Amino Alcohol MDA
- Bis(2-hydroxyethyl)-N-methylamine
- Diethanolmethylamine
- Ethanol, 2,2′-(methylimino)bis-
- Ethanol, 2,2′-(methylimino)di-
- Gas Spec CS 2000
- Genocure MDEA
- Jefftreat MS 100
- MDEA
- MDEA (diol)
- Methylbis(2-hydroxyethyl)amine
- Methyldiethanolamine
- Methyliminodiethanol
- N,N-Bis(2-hydroxyethyl)methylamine
- N,N-Di(2-hydroxyethyl)-N-methylamine
- N,N-Di(2-hydroxyethyl)methanamine
- N,N-Di(2-hydroxyethyl)methylamine
- N-(2-Hydroxyethyl)-N-methylethanolamine
- N-Methyl-N,N-bis(2-hydroxyethyl)amine
- N-Methyl-N,N-diethanolamine
- N-Methylaminodiglycol
- N-Methylbis(2-hydroxyethyl)amine
- N-Methyldiethanolamine
- N-Methyliminodiethanol
- Methydiethanolamine
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | CRVGTESFCCXCTH-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C5H13NO2/c1-6(2-4-7)3-5-8/h7-8H,2-5H2,1H3 |
| IUPAC name chemrof:IUPAC_name | 2,2'-methyliminodiethanol |
| Molecular formula chemrof:molecular_formula | C5H13NO2 |
| Molecular mass chemrof:molecular_mass | 119.164 |
| Monoisotopic mass chemrof:monoisotopic_mass | 119.094629 |
| SMILES string chemrof:smiles_string | CN(CCO)CCO |
Known URLs
13Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| ec342c8a-b69a-4ed6-8758-731a849402de | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 93c84065-a030-41f8-9e92-0108bcd4bef5 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 97502fdf-4d7e-4b04-b56c-500e76c2654a | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 7069235f-09cf-4b63-84ca-5cafd8c68244 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 2f61c008-1472-41e1-8c86-35fce1d1bda7 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 22ae45ec-8a1b-42da-90f4-7ddf81c7b250 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 7741b4c9-8929-4407-8c83-4097d69442ec | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 6eacd9c6-3c6e-42fa-ba7a-818066b59811 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 67b523d4-6485-45df-9bbe-287747dd9d1f | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 1b750c7c-de51-41e8-b4e4-288c2c45848a | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 88001b30-0fa3-41af-89c6-dee9f69adf63 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| b9be7c1c-6626-47ef-adf9-7343ebed77aa | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| c1d64e91-6bd2-47c1-84c1-6adb8043539f | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (55 changes)
Full record
Flow object JSON
{
"flow_object_id": "fo-4ce636a728d8173a",
"prefLabel": [
{
"@value": "2,2'-methyliminodiethanol",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "bootstrap_labels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "legacy name field"
}
}
],
"altLabel": [
{
"@value": "2,2′-(Methylimino)bis[ethanol]",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2,2′-(Methylimino)diethanol",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2-[(2-Hydroxyethyl)(methyl)amino]ethan-1-ol",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2-[(2-Hydroxyethyl)(methyl)amino]ethanol",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Amietol M 12",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Amino Alcohol MDA",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Bis(2-hydroxyethyl)-N-methylamine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Diethanolmethylamine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Ethanol, 2,2′-(methylimino)bis-",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Ethanol, 2,2′-(methylimino)di-",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Gas Spec CS 2000",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Genocure MDEA",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Jefftreat MS 100",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "MDEA",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "MDEA (diol)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Methylbis(2-hydroxyethyl)amine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Methyldiethanolamine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Methyliminodiethanol",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "N,N-Bis(2-hydroxyethyl)methylamine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "N,N-Di(2-hydroxyethyl)-N-methylamine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "N,N-Di(2-hydroxyethyl)methanamine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "N,N-Di(2-hydroxyethyl)methylamine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "N-(2-Hydroxyethyl)-N-methylethanolamine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "N-Methyl-N,N-bis(2-hydroxyethyl)amine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "N-Methyl-N,N-diethanolamine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "N-Methylaminodiglycol",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "N-Methylbis(2-hydroxyethyl)amine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "N-Methyldiethanolamine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "N-Methyliminodiethanol",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:105-59-9",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Methydiethanolamine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "carry_member_names",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:wasDerivedFrom": "source_flow_name"
}
}
],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C5H13NO2"
],
"attested_by": {
"C5H13NO2": [
"enrich_references.pubchem_semantic",
"rdkit_post_consensus"
]
},
"rdfs:label": "Molecular formula",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7767"
],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CN(CCO)CCO"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"CRVGTESFCCXCTH-UHFFFAOYSA-N"
],
"attested_by": {
"CRVGTESFCCXCTH-UHFFFAOYSA-N": [
"enrich_references.pubchem_semantic",
"rdkit_post_consensus"
]
},
"rdfs:label": "InChIKey",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7767"
],
"prov:wasDerivedFrom": "pubchem.props.InChIKey"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CN(CCO)CCO"
]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"rdfs:label": "SMILES",
"@value": [
"CN(CCO)CCO"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"2,2'-methyliminodiethanol"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CN(CCO)CCO"
]
}
],
"attested_by": {
"CN(CCO)CCO": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"rdfs:label": "InChI",
"@value": [
"InChI=1S/C5H13NO2/c1-6(2-4-7)3-5-8/h7-8H,2-5H2,1H3"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"2,2'-methyliminodiethanol"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CN(CCO)CCO"
]
}
],
"attested_by": {
"InChI=1S/C5H13NO2/c1-6(2-4-7)3-5-8/h7-8H,2-5H2,1H3": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"rdfs:label": "IUPAC name",
"@value": [
"2,2'-methyliminodiethanol"
],
"provenance": {
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"2,2'-methyliminodiethanol"
]
},
"attested_by": {
"2,2'-methyliminodiethanol": [
"opsin_iupac"
]
}
},
"https://w3id.org/chemrof/molecular_mass": {
"@id": "https://w3id.org/chemrof/molecular_mass",
"rdfs:label": "Molecular mass",
"@value": [
119.164
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CN(CCO)CCO"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CN(CCO)CCO"
]
}
],
"attested_by": {
"119.164": [
"rdkit_post_consensus",
"rdkit_pre_consensus"
]
},
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
},
"https://w3id.org/chemrof/monoisotopic_mass": {
"@id": "https://w3id.org/chemrof/monoisotopic_mass",
"rdfs:label": "Monoisotopic mass",
"@value": [
119.094629
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CN(CCO)CCO"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CN(CCO)CCO"
]
}
],
"attested_by": {
"119.094629": [
"rdkit_post_consensus",
"rdkit_pre_consensus"
]
},
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
}
},
"references": [
{
"@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J38.148I",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7767;CAS:105-59-9"
],
"prov:wasDerivedFrom": "pubchem.identifiers[105-59-9]"
}
},
{
"@id": "https://chem.echa.europa.eu/100.003.012",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7767;CAS:105-59-9"
],
"prov:wasDerivedFrom": "pubchem.identifiers[105-59-9]"
}
},
{
"@id": "https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1600",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7767;CAS:105-59-9"
],
"prov:wasDerivedFrom": "pubchem.identifiers[105-59-9]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=105-59-9",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"105-59-9"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID8025591",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7767;CAS:105-59-9"
],
"prov:wasDerivedFrom": "pubchem.identifiers[105-59-9]"
}
},
{
"@id": "https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=11690",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7767;CAS:105-59-9"
],
"prov:wasDerivedFrom": "pubchem.identifiers[105-59-9]"
}
},
{
"@id": "https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=49131",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7767;CAS:105-59-9"
],
"prov:wasDerivedFrom": "pubchem.identifiers[105-59-9]"
}
},
{
"@id": "https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=51500",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7767;CAS:105-59-9"
],
"prov:wasDerivedFrom": "pubchem.identifiers[105-59-9]"
}
},
{
"@id": "https://en.wikipedia.org/wiki/Methyldiethanolamine",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7767;CAS:105-59-9"
],
"prov:wasDerivedFrom": "pubchem.identifiers[105-59-9]"
}
},
{
"@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/3IG3K131QJ",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7767;CAS:105-59-9"
],
"prov:wasDerivedFrom": "pubchem.identifiers[105-59-9]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/7767",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7767;CAS:105-59-9"
],
"prov:wasDerivedFrom": "pubchem.by_cas[105-59-9]"
}
},
{
"@id": "https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3185149",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7767;CAS:105-59-9"
],
"prov:wasDerivedFrom": "pubchem.identifiers[105-59-9]"
}
},
{
"@id": "https://www.wikidata.org/wiki/Q252344",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7767;CAS:105-59-9"
],
"prov:wasDerivedFrom": "pubchem.identifiers[105-59-9]"
}
}
],
"created_from": {
"resolver": "hybrid_name_cas_v1",
"seed_uuid": "1b750c7c-de51-41e8-b4e4-288c2c45848a",
"seed_source": "EF 3.1",
"semantic_typing": {
"rule": "neutral_molecule",
"reason": "",
"types": [
"https://w3id.org/chemrof/NeutralMolecule"
],
"provenance": {
"prov:wasGeneratedBy": "semantic_typing.classify",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:wasDerivedFrom": "semantic_typing.rule.neutral_molecule"
}
}
},
"classifications": {
"http://semanticscience.org/resource/CHEMINF_000446": {
"@value": [
"105-59-9"
],
"rdfs:seeAlso": [
"https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
],
"http://www.w3.org/2004/02/skos/core#exactMatch": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=105-59-9"
}
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
"http://semanticscience.org/resource/CHEMINF_000447": {
"@value": [
"203-312-7"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=203-312-7"
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "ec_numbers"
}
}
},
"origin_qualifier": null,
"parent_flow_object_id": null,
"parent_intervention_id": null,
"@type": [
"https://w3id.org/chemrof/NeutralMolecule"
]
}