Consensus flow list

Identity

Type
Neutral molecule
CAS
108-18-9
EC
203-558-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Diisopropylamine

Alternative labels

8

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string UAOMVDZJSHZZME-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C6H15N/c1-5(2)7-6(3)4/h5-7H,1-4H3
IUPAC name chemrof:IUPAC_name Diisopropylamine
Molecular formula chemrof:molecular_formula C6H15N
Molecular mass chemrof:molecular_mass 101.193
Monoisotopic mass chemrof:monoisotopic_mass 101.120449
SMILES string chemrof:smiles_string CC(C)NC(C)C

Known URLs

16

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=108-18-9 enrich_references.consensus_cas_link
cdc.gov https://www.cdc.gov/niosh-rtecs/IM3D6AA8.html enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.003.235 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0449 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID9025085 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=6758 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1450356 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/BR9JLI40NO enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0251358 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.496F enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/7912 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#1158 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=060629 enrich_references.pubchem_identifier_url
rxnav.nlm.nih.gov https://rxnav.nlm.nih.gov/id/rxnorm/1362925 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q420331 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Diisopropylamine enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
f4538e39-8692-48bf-a91e-e902e01d0e13 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
ed7cedf1-726f-4b28-b45c-d4590865ba14 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
4ff288f3-2f6f-49b0-a2ba-1c819724396a Environmental → Air → Indoor EF 3.1 kg 4
e72bc666-1f89-4af2-aee7-5a8e99eac402 Environmental → Air → Long-term EF 3.1 kg 0
033a11e8-f537-446f-afca-13ef3c32e71e Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
17320a1e-0345-43e4-86ff-7a53d9e884b2 Environmental → Air → Unknown EF 3.1 kg 4
1475bc3a-866c-48b4-b562-e6bf01642270 Environmental → Ground → Agricultural EF 3.1 kg 4
2a1e0141-554f-4dfc-b15d-e843f41cca20 Environmental → Ground → Non-agricultural EF 3.1 kg 4
70120da1-8bc9-4cff-8a1a-f660f5724b61 Environmental → Ground → Unknown EF 3.1 kg 4
5c2f682e-003a-4d6b-9910-6123e31d888e Environmental → Water → Long-term EF 3.1 kg 0
32b25c72-d2f8-4c02-a846-193546f85597 Environmental → Water → Ocean EF 3.1 kg 4
06a31339-9fd9-4b0e-b262-60cd0ccf0625 Environmental → Water → Surface water EF 3.1 kg 4
c9dadc44-b040-49e5-9e88-36402d7e3f2e Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
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    },
    {
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    },
    {
      "@value": "N-Isopropylpropan-2-amine",
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        "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": [
        "203-558-5"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=203-558-5"
      ],
      "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,
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

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