Decylamine
fo-0069f4a247bd9e11
Identity
- Type
- Neutral molecule
- CAS
- 2016-57-1
- EC
- 217-957-7
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 56 across every transformer
Structure
Alternative labels
11- 1-Aminodecane
- 1-Decanamine
- 1-Decylamine
- Caprylamine
- decan-1-amine
- Decanamine
- Fentamine A 10
- Kemamine P 190D
- Monodecylamine
- n-Decylamine
- NDA
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | MHZGKXUYDGKKIU-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C10H23N/c1-2-3-4-5-6-7-8-9-10-11/h2-11H2,1H3 |
| IUPAC name chemrof:IUPAC_name | Decylamine |
| Molecular formula chemrof:molecular_formula | C10H23N |
| Molecular mass chemrof:molecular_mass | 157.301 |
| Monoisotopic mass chemrof:monoisotopic_mass | 157.18305 |
| SMILES string chemrof:smiles_string | CCCCCCCCCCN |
Known URLs
12Where 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.
| Resource | URL | Recorded by |
|---|---|---|
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=2016-57-1 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:166481 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.016.326 | enrich_references.pubchem_identifier_url |
| ChemSpider | https://www.chemspider.com/Chemical-Structure.8576.html | enrich_references.chebi_xrefs |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID2022171 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL109819 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/M9KKQ6ZZG9 | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0250927 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J7.849B | enrich_references.pubchem_identifier_url |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=78518 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/8916 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q5493262 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| d93073f7-a7dc-46ce-a498-dc2c58620e44 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 7c999728-5b82-4845-b833-34b4147ba41a | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| c46dd938-c04c-4811-bc89-67aa8979e135 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 3594e261-4210-400a-968b-220047493929 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 4f9e6372-0c6e-479f-9416-d789edc49a06 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 314bacb2-f1a5-4016-9dc1-259fbbcd665d | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 4d760bd2-8927-4031-9aff-8e0adae913f3 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| e28406b3-a548-4eb3-af18-f436d5203011 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| f1ff44bc-01f1-4c39-a175-c574f038f858 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| f137c4e0-e4f6-4760-a57d-a1efea4c500f | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 9b30f8c2-66b7-4e8b-9a65-ddccd6a9d7ea | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 68edfb32-47db-42cd-a8a6-35b2c5ea2c2a | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| f55050d3-d7f0-4059-8e74-b800e5a59bf3 | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (56 changes)
Full record
Flow object JSON
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"EF 3.1"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
"http://semanticscience.org/resource/CHEMINF_000447": {
"@value": [
"217-957-7"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=217-957-7"
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "brightway-flows",
"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"
]
}Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works