Consensus flow list

Identity

Type
Neutral molecule
CAS
75-31-0
EC
200-860-9
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Isopropylamine

Alternative labels

9

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string JJWLVOIRVHMVIS-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C3H9N/c1-3(2)4/h3H,4H2,1-2H3
IUPAC name chemrof:IUPAC_name Isopropylamine
Molecular formula chemrof:molecular_formula C3H9N
Molecular mass chemrof:molecular_mass 59.112
Monoisotopic mass chemrof:monoisotopic_mass 59.073499, 59.0735
SMILES string chemrof:smiles_string CC(C)N

Known URLs

24

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=75-31-0 enrich_references.chebi_xrefs
cdc.gov https://www.cdc.gov/niosh-rtecs/NT802C80.html enrich_references.pubchem_identifier_url
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:15739 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.000.783 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0908 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID2025682 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=62775 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL117080 enrich_references.pubchem_identifier_url
femaflavor.org https://www.femaflavor.org/flavor-library/isopropylamine enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/P8W26T4MTD enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0253679 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.451F enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C06748 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C06748 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=50241 enrich_references.pubchem_identifier_url
MetaCyc https://metacyc.org/compound?orgid=META&id=ISOPROPYLAMINE enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/6363 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#1221 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/23897436 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24365708 enrich_references.chebi_xrefs
reaxys reaxys:605259 enrich_references.chebi_xrefs
umbbd.compound umbbd.compound:c0656 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q420554 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Isopropylamine enrich_references.chebi_xrefs

Elementary flows

15
Flow Context Source Unit CFs
04fc25e4-abb3-4463-adbe-d9de1176ea74 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
341f67d4-0eda-42d8-9aca-ca6b9af04233 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
82a158bd-8a71-4b15-90b3-848bae4519c8 Environmental → Air → Indoor EF 3.1 kg 2
24bf8f64-e246-40b9-9576-762722f27efc Environmental → Air → Long-term EF 3.1 kg 0
750b604c-bffb-4f03-80f9-d7291ca717b3 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
d209b3b6-944f-482e-9a42-a818de873a58 Environmental → Air → Unknown EF 3.1 kg 2
13305562-dda5-4904-bdf4-cec35303a6bc Environmental → Ground → Agricultural EF 3.1 kg 2
706f88ac-f061-4fc3-a1db-533a4c46dc6c Environmental → Ground → Non-agricultural EF 3.1 kg 2
1b5e43a6-f067-4ad4-9461-0306ffdaafbe Environmental → Ground → Unknown EF 3.1 kg 2
1105c2ea-ce59-43c5-a160-5e1e95aec88d Environmental → Water → Long-term EF 3.1 kg 0
9a36ede1-4192-485a-a19c-1ab4cc404b5c Environmental → Water → Ocean EF 3.1 kg 2
9dce2f5287ffb8e7a0c2bd65214cbf4c40298e03 Environmental → Water → River bafu algorithm addition kg 0
478f031d-d257-4036-ad59-9b5eaefc244a Environmental → Water → Surface water EF 3.1 kg 2
b260e26885d68c27b356d7dc38f6bef6e3a41731 Environmental → Water → Unconfined aquifer ecoinvent algorithm addition kg 0
21698b8c-b563-433b-8cbf-f07e3dfa7d5e 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
{
  "flow_object_id": "fo-44c7986f8b5746a7",
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      "@value": "Isopropylamine",
      "@language": "en",
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        "prov:wasDerivedFrom": "legacy name field"
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  ],
  "altLabel": [
    {
      "@value": "1-Methylethylamine",
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    {
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    },
    {
      "@value": "2-Isopropylamine",
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    },
    {
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    },
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      "@value": "sec-Propylamine",
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