Consensus flow list

Identity

Type
Neutral molecule
CAS
2362-14-3
EC
219-110-7
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 4-[1-(4-hydroxy-3-methylphenyl)cyclohexyl]-2-methylphenol

Alternative labels

13

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string SVOBELCYOCEECO-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C20H24O2/c1-14-12-16(6-8-18(14)21)20(10-4-3-5-11-20)17-7-9-19(22)15(2)13-17/h6-9,12-13,21-22H,3-5,10-11H2,1-2H3
IUPAC name chemrof:IUPAC_name 4-[1-(4-hydroxy-3-methylphenyl)cyclohexyl]-2-methylphenol
Molecular formula chemrof:molecular_formula C20H24O2
Molecular mass chemrof:molecular_mass 296.41
Monoisotopic mass chemrof:monoisotopic_mass 296.17763
SMILES string chemrof:smiles_string Cc1cc(C2(c3ccc(O)c(C)c3)CCCCC2)ccc1O

Known URLs

10

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=2362-14-3 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.017.374 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.435.374 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID2074954 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=73731 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL2403359 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/PW8LG6KU6K enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J213.217F enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/75386 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q72459984 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
608410f0-6a80-474f-800c-9c1c9e63659e Environmental → Air → Aircraft cruise height EF 3.1 kg 4
15a696d3-4cea-420b-8285-fcfc252c7cdd Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
ada213a9-5557-4deb-a2aa-dff2b97e61f2 Environmental → Air → Indoor EF 3.1 kg 4
d12a947d-cef0-411e-a844-b5547418f95f Environmental → Air → Long-term EF 3.1 kg 0
028c74af-9430-4d3c-9215-00fdfa0aeec0 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
6fdc62a4-b7d9-4683-9fe9-076892d3faa4 Environmental → Air → Unknown EF 3.1 kg 4
92535ff7-3e79-498e-9d90-27b5adfd7c1e Environmental → Ground → Agricultural EF 3.1 kg 4
23202591-8b8c-46b4-afc4-205be7831f74 Environmental → Ground → Non-agricultural EF 3.1 kg 4
e8ae84c2-a535-4a88-a779-cdd1890714ac Environmental → Ground → Unknown EF 3.1 kg 4
2885d824-eb4b-49c2-8d81-7d79c7456343 Environmental → Water → Long-term EF 3.1 kg 0
393a4c3a-360e-4c3c-9e8c-b2a00a36d33e Environmental → Water → Ocean EF 3.1 kg 4
789d0608-4719-4229-9b46-8cdc810eeb90 Environmental → Water → Surface water EF 3.1 kg 4
1ef4d7bc-4b6c-4d62-9daf-04779fc2c0b7 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-5828eb2f9bae2e8a",
  "prefLabel": [
    {
      "@value": "4-[1-(4-hydroxy-3-methylphenyl)cyclohexyl]-2-methylphenol",
      "@language": "en",
      "@lang": "en",
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        "prov:hadPrimarySource": [
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        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "1,1-Bis(3-methyl-4-hydroxyphenyl)-3,3,5-cyclohexane",
      "@language": "en",
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      }
    },
    {
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    },
    {
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      }
    },
    {
      "@value": "4,4′-Cyclohexane-1,1-diylbis[2-methylphenol]",
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    },
    {
      "@value": "4,4′-Cyclohexylidenebis[2-methylphenol]",
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    },
    {
      "@value": "4,4′-Cyclohexylidenedi-o-cresol",
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      }
    },
    {
      "@value": "Bis(4-hydroxy-3-methylphenyl)cyclohexane",
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    },
    {
      "@value": "Bis-OC-Z",
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    },
    {
      "@value": "Bisphenol CZ",
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    },
    {
      "@value": "BPOCTMC",
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      }
    },
    {
      "@value": "o-Cresol, 4,4′-cyclohexylidenedi-",
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    },
    {
      "@value": "Phenol, 4,4′-cyclohexylidenebis[2-methyl-",
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  "properties": {
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        "C20H24O2"
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      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
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      "rdfs:label": "InChIKey",
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      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/C20H24O2/c1-14-12-16(6-8-18(14)21)20(10-4-3-5-11-20)17-7-9-19(22)15(2)13-17/h6-9,12-13,21-22H,3-5,10-11H2,1-2H3"
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  },
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        "https://commonchemistry.cas.org/detail?cas_rn=2362-14-3"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
        {
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        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "ec_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

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