Barium Dihydroxide
fo-f2a1b776317e60d4
Identity
- Type
- Chemical salt
- CAS
- 17194-00-2
- EC
- 241-234-5
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 56 across every transformer
Structure
Alternative labels
9- Aetzbaryt
- Ba(OH)2
- Barium hydroxide
- Barium hydroxide (Ba(OH)2)
- barium hydroxide lime
- barium(2+) hydroxide
- barium(II) hydroxide
- Bariumhydroxid
- caustic baryta
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | RQPZNWPYLFFXCP-UHFFFAOYSA-L |
| InChI2D string chemrof:inchi2d_string | InChI=1S/Ba.2H2O/h;2*1H2/q+2;;/p-2 |
| IUPAC name chemrof:IUPAC_name | Barium Dihydroxide |
| Molecular formula chemrof:molecular_formula | Ba.2HO, BaH2O2, H2BaO2 |
| Molecular mass chemrof:molecular_mass | 171.342 |
| Monoisotopic mass chemrof:monoisotopic_mass | 171.910727, 171.91073 |
| SMILES string chemrof:smiles_string | [Ba+2].[OH-].[OH-] |
Known URLs
11Where 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=17194-00-2 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:32592 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.037.470 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID10892155 | enrich_references.pubchem_identifier_url |
| gmelin | gmelin:846955 | enrich_references.chebi_xrefs |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/1OHB71MYBK | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J43.680A | enrich_references.pubchem_identifier_url |
| kegg.jp | https://www.kegg.jp/entry/D03055 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/6093286 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q407605 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Barium_hydroxide | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 1bf3b21c-3d6a-4497-aecb-482065b3e994 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 99b43873-b056-415a-8c95-be032bd433e8 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 701d969d-9319-4d88-92dd-8539c8992541 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| a2b125db-ae87-4ca4-8118-26c8f2656923 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 68c8db09-4a2f-4128-97c2-a68a552b58ef | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 56f5e809-7d29-454b-a2dc-37ef2cb6d1ad | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 763c8f9f-c7d3-46dd-8a3d-ae274bc78a61 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| ea81cbbe-015f-4ec3-baa8-62ea43bbe475 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| dda4fe5a-cf21-4fc7-ba1e-1cc521703eb6 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 6d449c9c-cc91-4dae-be46-5a35341226ba | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| ca66f188-0467-409b-be30-e2fe9c96e9b0 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 6dc40b6f-afb5-45d8-859c-b0ab19161c76 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 79904979-aaeb-459e-b36c-67e922d6c1bf | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (56 changes)
Full record
Flow object JSON
{
"flow_object_id": "fo-f2a1b776317e60d4",
"prefLabel": [
{
"@value": "Barium Dihydroxide",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "bootstrap_labels",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "legacy name field"
}
}
],
"altLabel": [
{
"@value": "Aetzbaryt",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_32592"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "Ba(OH)2",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_32592"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "Barium hydroxide",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CAS:17194-00-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=17194-00-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Barium hydroxide (Ba(OH)2)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CAS:17194-00-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=17194-00-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "barium hydroxide lime",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_32592"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "barium(2+) hydroxide",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_32592"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "barium(II) hydroxide",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_32592"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "Bariumhydroxid",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_32592"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "caustic baryta",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_32592"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
}
],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"Ba.2HO",
"BaH2O2",
"H2BaO2"
],
"attested_by": {
"Ba.2HO": [
"enrich_references.chebi_semantic"
],
"BaH2O2": [
"enrich_references.pubchem_semantic"
],
"H2BaO2": [
"rdkit_post_consensus",
"rdkit_pre_consensus"
]
},
"rdfs:label": "Molecular formula",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.chebi_semantic",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_32592"
],
"prov:wasDerivedFrom": "chebi.basic_property_values.generalized_empirical_formula"
},
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CID:6093286"
],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
},
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"[Ba+2].[OH-].[OH-]"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"[Ba+2].[OH-].[OH-]"
]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"rdfs:label": "SMILES",
"@value": [
"[Ba+2].[OH-].[OH-]"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"Barium Dihydroxide"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"[Ba+2].[OH-].[OH-]"
]
}
],
"attested_by": {
"[Ba+2].[OH-].[OH-]": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"rdfs:label": "InChI",
"@value": [
"InChI=1S/Ba.2H2O/h;2*1H2/q+2;;/p-2"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"Barium Dihydroxide"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"[Ba+2].[OH-].[OH-]"
]
}
],
"attested_by": {
"InChI=1S/Ba.2H2O/h;2*1H2/q+2;;/p-2": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"RQPZNWPYLFFXCP-UHFFFAOYSA-L"
],
"attested_by": {
"RQPZNWPYLFFXCP-UHFFFAOYSA-L": [
"enrich_references.chebi_semantic",
"enrich_references.pubchem_semantic",
"rdkit_post_consensus"
]
},
"rdfs:label": "InChIKey",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.chebi_semantic",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_32592"
],
"prov:wasDerivedFrom": "chebi.basic_property_values.inchi_key_string"
},
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CID:6093286"
],
"prov:wasDerivedFrom": "pubchem.props.InChIKey"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"[Ba+2].[OH-].[OH-]"
]
}
]
},
"https://w3id.org/chemrof/molecular_mass": {
"@id": "https://w3id.org/chemrof/molecular_mass",
"@value": [
171.342
],
"attested_by": {
"171.342": [
"enrich_references.chebi_semantic",
"rdkit_post_consensus"
]
},
"rdfs:label": "Molecular mass",
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.chebi_semantic",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_32592"
],
"prov:wasDerivedFrom": "chebi.basic_property_values.mass"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"[Ba+2].[OH-].[OH-]"
]
}
]
},
"https://w3id.org/chemrof/monoisotopic_mass": {
"@id": "https://w3id.org/chemrof/monoisotopic_mass",
"@value": [
171.910727,
171.91073
],
"attested_by": {
"171.91073": [
"enrich_references.chebi_semantic"
],
"171.910727": [
"rdkit_post_consensus",
"rdkit_pre_consensus"
]
},
"rdfs:label": "Monoisotopic mass",
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.chebi_semantic",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_32592"
],
"prov:wasDerivedFrom": "chebi.basic_property_values.monoisotopic_mass"
},
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"[Ba+2].[OH-].[OH-]"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"[Ba+2].[OH-].[OH-]"
]
}
]
},
"https://w3id.org/chemrof/elemental_charge": {
"@id": "https://w3id.org/chemrof/elemental_charge",
"@value": [
0
],
"attested_by": {
"0": [
"enrich_references.chebi_semantic"
]
},
"rdfs:label": "Elemental charge",
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/NUM",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_semantic",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_32592"
],
"prov:wasDerivedFrom": "chebi.basic_property_values.charge"
}
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"rdfs:label": "IUPAC name",
"@value": [
"Barium Dihydroxide"
],
"provenance": {
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"Barium Dihydroxide"
]
},
"attested_by": {
"Barium Dihydroxide": [
"opsin_iupac"
]
}
}
},
"references": [
{
"@id": "gmelin:846955",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_xrefs",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_32592"
],
"prov:wasDerivedFrom": "chebi.xrefs_urls"
}
},
{
"@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J43.680A",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CID:6093286;CAS:17194-00-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[17194-00-2]"
}
},
{
"@id": "https://chem.echa.europa.eu/100.037.470",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CID:6093286;CAS:17194-00-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[17194-00-2]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=17194-00-2",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_xrefs",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_32592"
],
"prov:wasDerivedFrom": "chebi.xrefs_urls"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID10892155",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CID:6093286;CAS:17194-00-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[17194-00-2]"
}
},
{
"@id": "https://en.wikipedia.org/wiki/Barium_hydroxide",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CID:6093286;CAS:17194-00-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[17194-00-2]"
}
},
{
"@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/1OHB71MYBK",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CID:6093286;CAS:17194-00-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[17194-00-2]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/6093286",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CID:6093286;CAS:17194-00-2"
],
"prov:wasDerivedFrom": "pubchem.by_cas[17194-00-2]"
}
},
{
"@id": "https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:32592",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_id_link",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_32592"
],
"prov:wasDerivedFrom": "chebi.id"
}
},
{
"@id": "https://www.kegg.jp/entry/D03055",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CID:6093286;CAS:17194-00-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[17194-00-2]"
}
},
{
"@id": "https://www.wikidata.org/wiki/Q407605",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CID:6093286;CAS:17194-00-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[17194-00-2]"
}
}
],
"created_from": {
"resolver": "hybrid_name_cas_v1",
"seed_uuid": "1bf3b21c-3d6a-4497-aecb-482065b3e994",
"seed_source": "EF 3.1",
"semantic_typing": {
"rule": "multi_component_ionic",
"reason": "",
"types": [
"https://w3id.org/chemrof/ChemicalSalt"
],
"provenance": {
"prov:wasGeneratedBy": "semantic_typing.classify",
"prov:wasAttributedTo": "brightway-flows",
"prov:wasDerivedFrom": "semantic_typing.rule.multi_component_ionic"
}
}
},
"classifications": {
"http://semanticscience.org/resource/CHEMINF_000446": {
"@value": [
"17194-00-2"
],
"rdfs:seeAlso": [
"https://commonchemistry.cas.org/detail?cas_rn=17194-00-2"
],
"http://www.w3.org/2004/02/skos/core#exactMatch": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=17194-00-2"
}
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
"http://semanticscience.org/resource/CHEMINF_000447": {
"@value": [
"241-234-5"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=241-234-5"
],
"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/ChemicalSalt"
]
}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