Consensus flow list

Identity

Type
NeutralMolecule
CAS
6297-03-6
EC
228-567-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 1,1'-oxydioctadecane

Alternative labels

9

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string HBXWUCXDUUJDRB-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C36H74O/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-36H2,1-2H3
IUPAC name chemrof:IUPAC_name 1,1'-oxydioctadecane
Molecular formula chemrof:molecular_formula C36H74O
Molecular mass chemrof:molecular_mass 522.987
Monoisotopic mass chemrof:monoisotopic_mass 522.573967
SMILES string chemrof:smiles_string CCCCCCCCCCCCCCCCCCOCCCCCCCCCCCCCCCCCC

Known URLs

8

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=6297-03-6 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.025.971 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID10864175 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=17520 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/SC6T3MJF8Y enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J27.073C enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/80526 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27289134 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
a2df2ad0-9a38-4925-926d-cca1905c13c7 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
8c1cef8a-0947-49c1-8058-61a9a6c0266d Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
4061ef44-3f59-4777-bdc9-f2034ad1add5 Environmental → Air → Indoor EF 3.1 kg 2
664b274a-8c8e-4196-9d29-6d17fb33047d Environmental → Air → Long-term EF 3.1 kg 0
ad958928-31ba-4d64-8854-0d66cb0f018d Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
51275131-29fb-4b9f-8836-21789ea353a6 Environmental → Air → Unknown EF 3.1 kg 2
4c15c38d-bfc5-43da-a340-407fb792cf19 Environmental → Ground → Agricultural EF 3.1 kg 2
31b3c13c-ce5e-41a0-93ce-f5ddfba22c78 Environmental → Ground → Non-agricultural EF 3.1 kg 2
8bde3e27-a3c8-4eb6-ac52-67605c171aae Environmental → Ground → Unknown EF 3.1 kg 2
1de7822f-f5ff-4232-b55d-fe39d8319d17 Environmental → Water → Long-term EF 3.1 kg 0
4d3e9cac-6230-4b2a-b5f0-84c4cf36b616 Environmental → Water → Ocean EF 3.1 kg 2
3355f098-fa81-4b5f-ac73-fbde142703b8 Environmental → Water → Surface water EF 3.1 kg 2
483a2829-4413-41c7-95ef-5560a9b65ce5 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-0fdc4c34ad174f27",
  "prefLabel": [
    {
      "@value": "1,1'-oxydioctadecane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "1,1′-Oxybis[octadecane]",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:6297-03-6",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=6297-03-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1-Octadecoxyoctadecane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:6297-03-6",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=6297-03-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Cosmacol SE",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:6297-03-6",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=6297-03-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Di-n-octadecyl ether",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=6297-03-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Dioctadecyl ether",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:6297-03-6",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=6297-03-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Distearyl ether",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Nacol 18",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Octadecane, 1,1′-oxybis-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "EF 3.1",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Octadecyl ether",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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          "https://commonchemistry.cas.org/detail?cas_rn=6297-03-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "properties": {
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        },
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      "rdfs:label": "InChIKey",
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    },
    "https://w3id.org/chemrof/smiles_string": {
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      "rdfs:label": "SMILES",
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      ],
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    },
    "https://w3id.org/chemrof/inchi2d_string": {
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      "rdfs:label": "InChI",
      "@value": [
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    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
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      "@value": [
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    }
  },
  "references": [
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    "seed_uuid": "1de7822f-f5ff-4232-b55d-fe39d8319d17",
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    "semantic_typing": {
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  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
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}

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