Consensus flow list

Identity

Type
Neutral molecule
CAS
58670-89-6
EC
261-385-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
53 across every transformer

Structure

Structure diagram for 2-decyltetradecan-1-ol

Alternative labels

13

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string CAYHVMBQBLYQMT-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C24H50O/c1-3-5-7-9-11-13-14-16-18-20-22-24(23-25)21-19-17-15-12-10-8-6-4-2/h24-25H,3-23H2,1-2H3
IUPAC name chemrof:IUPAC_name 2-decyltetradecan-1-ol
Molecular formula chemrof:molecular_formula C24H50O
Molecular mass chemrof:molecular_mass 354.663
Monoisotopic mass chemrof:monoisotopic_mass 354.386166
SMILES string chemrof:smiles_string CCCCCCCCCCCCC(CO)CCCCCCCCCC

Known URLs

7

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=58670-89-6 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.055.786 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID60886281 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/L6W1BEW5ES enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J297.000G enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/93875 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27282784 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
c49ad7bb-133f-4aae-ad3c-392de2a0c239 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
9c554a8e-8779-446d-a1ef-8acde5d217a8 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
e13c8b6f-9e48-462c-a611-8a908b9e2919 Environmental → Air → Indoor EF 3.1 kg 2
1c9a2a4a-a38b-4f84-8ee8-85b833f7b2dc Environmental → Air → Long-term EF 3.1 kg 0
6e23ca51-0fca-48d6-92e0-f37e298537b3 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
789e4934-ac29-41df-bc0f-07e01262160c Environmental → Air → Unknown EF 3.1 kg 2
75c58a59-782e-4316-a3ab-7c9a4f030ac4 Environmental → Ground → Agricultural EF 3.1 kg 2
e4c32f85-db80-4164-990f-5f6e95433768 Environmental → Ground → Non-agricultural EF 3.1 kg 2
e42a680b-c8f6-4d90-afe7-10a0267e3b73 Environmental → Ground → Unknown EF 3.1 kg 2
3f3e336c-5d30-4f3a-8e62-adc4c345e9d9 Environmental → Water → Long-term EF 3.1 kg 0
f4f1e5e1-685c-4802-9dbd-bbbe1e2c1c2f Environmental → Water → Ocean EF 3.1 kg 2
3c480f48-05cf-46ff-87c4-9f0f2f5da6e5 Environmental → Water → Surface water EF 3.1 kg 2
a548a218-03e3-4361-b8c9-9208a619da28 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (53 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-b001712a92d869c1",
  "prefLabel": [
    {
      "@value": "2-decyltetradecan-1-ol",
      "@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-Tetradecanol, 2-decyl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58670-89-6",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58670-89-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Decyl-1-tetradecanol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58670-89-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Decylmyristyl alcohol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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          "https://commonchemistry.cas.org/detail?cas_rn=58670-89-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Decyltetradecanol",
      "@language": "en",
      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Decyltetradecyl alcohol",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Dodecyl-1-dodecanol",
      "@language": "en",
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      "provenance": {
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        ],
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      }
    },
    {
      "@value": "Decyltetradecanol",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Decyltetradecyl alcohol",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Guerbet C24",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Isofol 24",
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      }
    },
    {
      "@value": "Jarcol I 24",
      "@language": "en",
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      }
    },
    {
      "@value": "NJCOL 240A",
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        ],
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      }
    },
    {
      "@value": "Risonol 24SP",
      "@language": "en",
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      "provenance": {
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  ],
  "properties": {
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      "@id": "https://w3id.org/chemrof/molecular_formula",
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        "C24H50O"
      ],
      "attested_by": {
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      },
      "rdfs:label": "Molecular formula",
      "provenance": [
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        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
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          "prov:hadPrimarySource": [
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      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "CAYHVMBQBLYQMT-UHFFFAOYSA-N"
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      "rdfs:label": "InChIKey",
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        },
        {
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          "prov:hadPrimarySource": [
            "CCCCCCCCCCCCC(CO)CCCCCCCCCC"
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        }
      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
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      ],
      "provenance": [
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  "references": [
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}

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