Consensus flow list

Identity

Type
Chemical salt
CAS
1643-19-2
EC
216-699-2
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Tetrabutylammonium bromide

Alternative labels

12

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string JRMUNVKIHCOMHV-UHFFFAOYSA-M
InChI2D string chemrof:inchi2d_string InChI=1S/C16H36N.BrH/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;/h5-16H2,1-4H3;1H/q+1;/p-1
IUPAC name chemrof:IUPAC_name Tetrabutylammonium bromide
Molecular formula chemrof:molecular_formula Br.C16H36N, C16H36BrN
Molecular mass chemrof:molecular_mass 322.375
Monoisotopic mass chemrof:monoisotopic_mass 321.20311, 321.203112
SMILES string chemrof:smiles_string CCCC[N+](CCCC)(CCCC)CCCC.[Br-]

Known URLs

14

Where 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=1643-19-2 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:51993 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.015.182 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID4044400 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL60696 enrich_references.pubchem_identifier_url
gmelin gmelin:15077 enrich_references.chebi_xrefs
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/VJZ168I98R enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=58017 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/74236 enrich_references.pubchem_compound
PubMed https://pubmed.ncbi.nlm.nih.gov/23350852 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24932572 enrich_references.chebi_xrefs
reaxys reaxys:3570983 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q6296780 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Tetrabutylammonium_bromide enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
eb28760f-4302-4db7-873e-84749ce51e1e Environmental → Air → Aircraft cruise height EF 3.1 kg 2
7d7807e9-fca5-4a77-bafd-3f84e9778774 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
d0ba93c3-4c45-4a1d-a261-da799eb70f9a Environmental → Air → Indoor EF 3.1 kg 2
3f8a95a9-b0cb-42f7-a0e0-78ead99fe9fa Environmental → Air → Long-term EF 3.1 kg 0
37a27b33-4408-429e-a1a4-507cf8613b31 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
400f0b79-57cf-40a8-b603-4a43b0e50b3a Environmental → Air → Unknown EF 3.1 kg 2
8539fb26-72e6-4ff9-944f-057a3945392d Environmental → Ground → Agricultural EF 3.1 kg 2
6b9a59c2-d0f6-4de4-beb1-cdbccbfe29c1 Environmental → Ground → Non-agricultural EF 3.1 kg 2
0920ce14-8ae5-4f5b-95d9-9e1f324ed60b Environmental → Ground → Unknown EF 3.1 kg 2
d5bab886-a69c-48a0-8ed9-453940cf0015 Environmental → Water → Long-term EF 3.1 kg 0
9a8cefb1-8f54-4ca4-94dd-33ea34c8f167 Environmental → Water → Ocean EF 3.1 kg 2
54455e7c-e6e9-47e7-8d11-01ec30906c00 Environmental → Water → Surface water EF 3.1 kg 2
57513af5-b00b-479c-bf3e-921876457db6 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (58 changes)

Open the changes page

Full record

Flow object JSON
{
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  "altLabel": [
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