Consensus flow list

Identity

Type
Neutral molecule
CAS
110-31-6
EC
203-756-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for N,n'-ethane-1,2-diylbisoctadec-9-enamide

This substance carries 2 candidate structures; the diagram is the first one RDKit could parse, not a settled answer.

Alternative labels

24

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string OXDXXMDEEFOVHR-CLFAGFIQSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C38H72N2O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37(41)39-35-36-40-38(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20H,3-16,21-36H2,1-2H3,(H,39,41)(H,40,42)/b19-17-,20-18-
Isomeric SMILES string chemrof:isomeric_smiles_string CCCCCCCC/C=C\CCCCCCCC(=O)NCCNC(=O)CCCCCCC/C=C\CCCCCCCC
IUPAC name chemrof:IUPAC_name (9Z,9′Z)-N,N′-1,2-Ethanediylbis[9-octadecenamide]
Molecular formula chemrof:molecular_formula C38H72N2O2
Molecular mass chemrof:molecular_mass 589.006
Monoisotopic mass chemrof:monoisotopic_mass 588.55938
SMILES string chemrof:smiles_string CCCCCCCCC=CCCCCCCCC(=O)NCCNC(=O)CCCCCCCC=CCCCCCCCC

Known URLs

6

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=110-31-6 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.003.416 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/TMN5HDE2GX enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J193.582H enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/6436065 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27290027 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
2b211f44-009d-4412-92e2-637910e876e4 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
5c222cc7-9e70-4238-b583-590c15d4701c Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
5af4a996-9c43-4141-8fe3-3ffc41364b8b Environmental → Air → Indoor EF 3.1 kg 4
59c32d3a-c3b3-44e0-8878-1f1a408a20d8 Environmental → Air → Long-term EF 3.1 kg 0
f3e4eff6-e5ff-4c48-ba6d-ca02e956349c Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
c305cd5a-d985-4b40-9209-69ced6eb04e8 Environmental → Air → Unknown EF 3.1 kg 4
2460d3a3-7d9c-4094-8b4b-09ba18e9d0ea Environmental → Ground → Agricultural EF 3.1 kg 4
4e3f373c-7a77-40a3-97fe-0f1f7da11ec9 Environmental → Ground → Non-agricultural EF 3.1 kg 4
bd329893-b55d-4c7d-93b5-54512897075d Environmental → Ground → Unknown EF 3.1 kg 4
347e6698-add2-486e-9fcf-7e9a42d42a48 Environmental → Water → Long-term EF 3.1 kg 0
1a665ed5-52a2-4c02-b356-fcacdf262188 Environmental → Water → Ocean EF 3.1 kg 4
26d89ee2-7365-48a2-ab31-8a4fe68493f9 Environmental → Water → Surface water EF 3.1 kg 4
96c9d081-04b2-46ee-9d42-d688a9a76ff6 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
{
  "flow_object_id": "fo-42b792f3c62622b4",
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  ],
  "altLabel": [
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    },
    {
      "@value": "9-Octadecenamide, N,N′-1,2-ethanediylbis-, (9Z,9′Z)-",
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    },
    {
      "@value": "EBO-SPO",
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      }
    },
    {
      "@value": "Ethylene bisoleylamide",
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      }
    },
    {
      "@value": "Ethylenebis(oleamide)",
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      }
    },
    {
      "@value": "Ethylenebis[oleic acid amide]",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Ethylenebisoleoylamide",
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        ],
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      }
    },
    {
      "@value": "Finawax VL",
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    },
    {
      "@value": "Glycolube VL",
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    },
    {
      "@value": "Itohwax J 500",
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      }
    },
    {
      "@value": "Kemamide W 20",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "N,N′-Dioleoylethylenediamine",
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        ],
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      }
    },
    {
      "@value": "N,N′-Ethylenebis(oleic amide)",
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    },
    {
      "@value": "N,N′-Ethylenebis[oleamide]",
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    },
    {
      "@value": "N,N′-Ethylenebisoleylamide",
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      }
    },
    {
      "@value": "N,N′-Ethylenedioleamide",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Oleamide, N,N′-ethylenebis-",
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        ],
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    },
    {
      "@value": "Slipacks O",
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      }
    },
    {
      "@value": "Slipax O",
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  ],
  "properties": {
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      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C38H72N2O2"
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      "attested_by": {
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      "provenance": [
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          "prov:hadPrimarySource": [
            "CCCCCCCC/C=C\\CCCCCCCC(=O)NCCNC(=O)CCCCCCC/C=C\\CCCCCCCC"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "OXDXXMDEEFOVHR-CLFAGFIQSA-N"
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      "rdfs:label": "InChIKey",
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    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
        "CCCCCCCCC=CCCCCCCCC(=O)NCCNC(=O)CCCCCCCC=CCCCCCCCC"
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      "provenance": [
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      "rdfs:label": "InChI",
      "@value": [
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    },
    "https://w3id.org/chemrof/IUPAC_name": {
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      "rdfs:label": "IUPAC name",
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    "https://w3id.org/chemrof/molecular_mass": {
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      "rdfs:label": "Molecular mass",
      "@value": [
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}

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