Isopropylamine
fo-44c7986f8b5746a7
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
Alternative labels
9- 1-Methylethylamine
- 2-Aminopropane
- 2-Isopropylamine
- 2-Propanamine
- 2-Propylamine
- Monoisopropylamine
- propan-2-amine
- Propan-2-ylamine
- sec-Propylamine
Properties
| Property | Value |
|---|---|
| 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
24Where 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 | 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)
Full record
Flow object JSON
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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