Consensus flow list

Identity

Type
Neutral molecule
CAS
124-02-7
EC
204-671-2
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Diallylamine

Alternative labels

8

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string DYUWTXWIYMHBQS-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C6H11N/c1-3-5-7-6-4-2/h3-4,7H,1-2,5-6H2
IUPAC name chemrof:IUPAC_name Diallylamine
Molecular formula chemrof:molecular_formula C6H11N
Molecular mass chemrof:molecular_mass 97.161
Monoisotopic mass chemrof:monoisotopic_mass 97.089149
SMILES string chemrof:smiles_string C=CCNCC=C

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=124-02-7 enrich_references.consensus_cas_link
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=62238-80-6 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.004.248 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0866 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID1024918 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=20948 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3186706 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/N18EXB6V6P enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0251129 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.503H enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/31279 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#2359 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q1208441 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Diallylamine enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
d38d4c0f-77a6-4565-8bf4-10efc5fa5248 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
4cf9ffcc-1a23-47fe-bcd1-627b2c154c45 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
106cc3c6-fc19-4a51-9bbe-3498e0065296 Environmental → Air → Indoor EF 3.1 kg 2
e39e9b68-184c-412b-adc4-b5c8dc14c2db Environmental → Air → Long-term EF 3.1 kg 0
35494a24-e4af-4d20-8ab6-818e364de6a3 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
672254f0-b7c5-48ad-a4ae-4caf7a64dbba Environmental → Air → Unknown EF 3.1 kg 2
34563814-076b-4549-bd81-7a3f19ff8242 Environmental → Ground → Agricultural EF 3.1 kg 2
0cdf2e56-566a-4570-9aed-bd4f735d84bb Environmental → Ground → Non-agricultural EF 3.1 kg 2
5f8214b2-7583-4f1c-a7f5-a95d519f170c Environmental → Ground → Unknown EF 3.1 kg 2
15ba8484-e825-4c09-b39b-ec404096b097 Environmental → Water → Long-term EF 3.1 kg 0
66a18f78-99d7-4c81-b587-2bd33ea5849b Environmental → Water → Ocean EF 3.1 kg 2
d031a8d5-c40b-4f7f-8551-c915b99c3370 Environmental → Water → Surface water EF 3.1 kg 2
66578f89-90b5-4f1b-b21a-76bcdd0b7438 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-f79285741d422222",
  "prefLabel": [
    {
      "@value": "Diallylamine",
      "@language": "en",
      "@lang": "en",
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        "prov:wasDerivedFrom": "legacy name field"
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    }
  ],
  "altLabel": [
    {
      "@value": "2-Propen-1-amine, N-2-propen-1-yl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
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      }
    },
    {
      "@value": "2-Propen-1-amine, N-2-propenyl-",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Bis-allylamine",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Bisallylamine",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Di-2-propenylamine",
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    },
    {
      "@value": "N,N-Bis(allyl)amine",
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    },
    {
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    },
    {
      "@value": "N-2-propenyl-2-propen-1-amine",
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}

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