Consensus flow list

Identity

Type
NeutralMolecule
CAS
996-35-0
EC
213-635-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for N,n-dimethylpropan-2-amine

Alternative labels

7

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string VMOWKUTXPNPTEN-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C5H13N/c1-5(2)6(3)4/h5H,1-4H3
IUPAC name chemrof:IUPAC_name 2-Dimethylaminopropane
Molecular formula chemrof:molecular_formula C5H13N
Molecular mass chemrof:molecular_mass 87.166
Monoisotopic mass chemrof:monoisotopic_mass 87.104799
SMILES string chemrof:smiles_string CC(C)N(C)C

Known URLs

9

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=996-35-0 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.012.395 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID2033447 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1524256 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/WA4TE070J7 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J149.687E enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=123593 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/70452 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q23993292 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
d306276b-e17a-434a-a61e-2ba7fd7b65ab Environmental → Air → Aircraft cruise height EF 3.1 kg 4
672fae99-362f-4c09-bfee-e80caf6c5a0c Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
672e27a8-b85b-49df-92e3-1f18e1e5d55a Environmental → Air → Indoor EF 3.1 kg 4
009e50e5-1916-4f55-ac83-ddb92f5384ab Environmental → Air → Long-term EF 3.1 kg 0
a3c92976-cda7-4eaf-b61a-1599acc62552 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
711a379f-1fe8-4cb3-bdc9-9b1c25f796df Environmental → Air → Unknown EF 3.1 kg 4
ec5a99d0-4f66-4196-b843-f0fbea16d824 Environmental → Ground → Agricultural EF 3.1 kg 4
a80a2037-3f44-4ddc-8a1b-c288537e2053 Environmental → Ground → Non-agricultural EF 3.1 kg 4
c283020c-f0eb-4477-bd53-9effb9289c64 Environmental → Ground → Unknown EF 3.1 kg 4
12e67e77-f182-48b0-a0ea-2bce5bac4956 Environmental → Water → Long-term EF 3.1 kg 0
b67529ec-edae-4524-b764-5f972b04fb1c Environmental → Water → Ocean EF 3.1 kg 4
640381ca-6990-4541-918c-14060d6fbbaf Environmental → Water → Surface water EF 3.1 kg 4
cf39a4ae-16a1-47a4-b3c9-a74ada8aee2d Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-51cd21886658100d",
  "prefLabel": [
    {
      "@value": "N,n-dimethylpropan-2-amine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "2-Dimethylaminopropane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "https://commonchemistry.cas.org/detail?cas_rn=996-35-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Propanamine, N,N-dimethyl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Dimethylisopropylamine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
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      }
    },
    {
      "@value": "Ethylamine, N,N,1-trimethyl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Isopropyldimethylamine",
      "@language": "en",
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    },
    {
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    {
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}

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