Tetrapropylammonium bromide
fo-581244e47cc736b9
Identity
- Type
- Chemical salt
- CAS
- 1941-30-6
- EC
- 217-727-6
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 58 across every transformer
Structure
Alternative labels
8- 1-Propanaminium, N,N,N-tripropyl-, bromide
- 1-Propanaminium, N,N,N-tripropyl-, bromide (1:1)
- Ammonium, tetrapropyl-, bromide
- N,N,N-tripropyl-1-propanaminium bromide
- N,N,N-tripropyl-1-propanaminium bromide (1:1)
- N,n,n-tripropylpropan-1-aminium Bromide
- tetra-n-propylammonium bromide
- TPABr
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | BGQMOFGZRJUORO-UHFFFAOYSA-M |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C12H28N.BrH/c1-5-9-13(10-6-2,11-7-3)12-8-4;/h5-12H2,1-4H3;1H/q+1;/p-1 |
| IUPAC name chemrof:IUPAC_name | Tetrapropylammonium bromide |
| Molecular formula chemrof:molecular_formula | Br.C12H28N, C12H28BrN |
| Molecular mass chemrof:molecular_mass | 266.267 |
| Monoisotopic mass chemrof:monoisotopic_mass | 265.14051, 265.140512 |
| SMILES string chemrof:smiles_string | CCC[N+](CCC)(CCC)CCC.[Br-] |
Known URLs
14Where 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=1941-30-6 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:55318 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.016.116 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID9026130 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3561370 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/220T63791N | enrich_references.pubchem_identifier_url |
| patent | patent:CN101148411 | enrich_references.chebi_xrefs |
| patent | patent:EP0335067 | enrich_references.chebi_xrefs |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/74745 | enrich_references.pubchem_compound |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21591705 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/6196640 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/9101237 | enrich_references.chebi_xrefs |
| reaxys | reaxys:3567846 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q27124224 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 62527a00-57de-4511-ab34-1e9404a1354b | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 0c49b1c9-cbf5-4182-af5f-e861e0759e87 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 6aa9db46-2f8f-4f63-94eb-cbc78b280ff8 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 43d9580b-ff94-4f9c-a33a-75bba5eec7dc | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 2e7dba16-b326-4612-8700-d700a3d12b2a | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 014da380-0af0-43f1-b378-d5268a95bede | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 470b9814-664e-4338-a8e3-57290aaa01b4 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| c046246d-25fd-451f-82d4-9ff5e988da96 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 8839c706-63a4-4315-a92b-397bce71b151 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| e853b9b4-06b1-4af3-a99a-5c4e5548e6c3 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 6163b732-ea69-4f01-8e14-08d23f510996 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| d11bfdcd-75d7-477c-98c2-4d39d449b780 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| eca049dd-47ba-4bb5-b554-3f9b6a952b05 | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (58 changes)
Full record
Flow object JSON
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"http://semanticscience.org/resource/CHEMINF_000446": {
"@value": [
"1941-30-6"
],
"rdfs:seeAlso": [
"https://commonchemistry.cas.org/detail?cas_rn=1941-30-6"
],
"http://www.w3.org/2004/02/skos/core#exactMatch": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=1941-30-6"
}
],
"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": [
"217-727-6"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=217-727-6"
],
"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 quarternary ammonium bromide salt in which the cation has four propyl substituents around the central nitrogen.",
"@language": "en",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_definition",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_55318"
],
"prov:wasDerivedFrom": "chebi.definition"
}
}
],
"@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