Tripropylamine
fo-489e4622cba80108
Identity
- Type
- Neutral molecule
- CAS
- 102-69-2
- EC
- 203-047-7
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 56 across every transformer
Structure
Alternative labels
8- (n-C3H7)3N
- 1-Propanamine, N,N-dipropyl-
- N,N,N-Tri-n-propylamine
- N,N-dipropyl-1-propanamine
- N,N-dipropylpropan-1-amine
- NPr3
- propyldi-n-propylamine
- tri-n-propylamine
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | YFTHZRPMJXBUME-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C9H21N/c1-4-7-10(8-5-2)9-6-3/h4-9H2,1-3H3 |
| IUPAC name chemrof:IUPAC_name | Tripropylamine |
| Molecular formula chemrof:molecular_formula | C9H21N |
| Molecular mass chemrof:molecular_mass | 143.274 |
| Monoisotopic mass chemrof:monoisotopic_mass | 143.1674 |
| SMILES string chemrof:smiles_string | CCCN(CCC)CCC |
Known URLs
17Where 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=102-69-2 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:38880 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.002.771 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID9021849 | enrich_references.pubchem_identifier_url |
| femaflavor.org | https://www.femaflavor.org/flavor-library/tripropylamine | enrich_references.pubchem_identifier_url |
| gmelin | gmelin:101540 | enrich_references.chebi_xrefs |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/06S624V3U2 | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0032545 | enrich_references.chebi_xrefs |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J26.188B | enrich_references.pubchem_identifier_url |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=45593 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/7616 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/erg/#2260 | enrich_references.pubchem_identifier_url |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23055390 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/24437695 | enrich_references.chebi_xrefs |
| reaxys | reaxys:1098331 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q1637944 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Tripropylamine | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 75c021b9-7271-435c-a858-dac639178f40 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| e8c6ffd9-9a2c-4232-bcb1-cfb5cb360540 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 67686fee-5c1c-4950-a0e3-4eb5c9022a71 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 693445c3-5c8a-45e9-96d3-7a2c5463fdca | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 853e4165-a4e6-4a0c-b52f-e333677df29d | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| e373994f-d3bf-481e-8383-de1129a8ec26 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 43ec5067-0c89-4bee-bc11-091cae663edd | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| cbf52ffc-61f0-4dfc-92f6-a781c3614fb7 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 9f059bb0-8f77-4897-9000-d6e74c0a676c | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 390f6912-2f47-4e77-8afd-ae0d0df452f2 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| d32c675a-2207-46e9-ac4b-7039e72cebd4 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 8448bef4-6272-400c-9e74-aa0a135555bc | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 48911ce1-ceb5-4509-a8cd-5a54ed52f3f3 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (56 changes)
Full record
Flow object JSON
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"seed_uuid": "390f6912-2f47-4e77-8afd-ae0d0df452f2",
"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": [
"102-69-2"
],
"rdfs:seeAlso": [
"https://commonchemistry.cas.org/detail?cas_rn=102-69-2"
],
"http://www.w3.org/2004/02/skos/core#exactMatch": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=102-69-2"
}
],
"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": [
"203-047-7"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=203-047-7"
],
"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,
"http://www.w3.org/2004/02/skos/core#definition": [
{
"@value": "A tertiary amine that is ammonia in which each hydrogen atom is substituted by a propyl group.",
"@language": "en",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_definition",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_38880"
],
"prov:wasDerivedFrom": "chebi.definition"
}
}
],
"@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