Consensus flow list

Identity

Type
Neutral molecule
CAS
80-06-8
EC
201-246-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for Chlorfenethol

Alternative labels

20

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string URYAFVKLYSEINW-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C14H12Cl2O/c1-14(17,10-2-6-12(15)7-3-10)11-4-8-13(16)9-5-11/h2-9,17H,1H3
IUPAC name chemrof:IUPAC_name 1,1-Bis(4-chlorophenyl)ethan-1-ol
Molecular formula chemrof:molecular_formula C14H12Cl2O
Molecular mass chemrof:molecular_mass 267.155
Monoisotopic mass chemrof:monoisotopic_mass 266.02652
SMILES string chemrof:smiles_string CC(O)(c1ccc(Cl)cc1)c1ccc(Cl)cc1

Known URLs

13

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=80-06-8 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:82154 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.001.134 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID7040283 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=2848 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1522056 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/L0079FA965 enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0250094 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J5.509C enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C19023 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C19023 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/6624 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q1920106 enrich_references.pubchem_identifier_url

Elementary flows

14
Flow Context Source Unit CFs
b2cd6404-0b46-4677-aa4e-35ba3864fb04 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
7458886f-0539-44a0-b5a7-7713503650fa Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
caad08e9-12c4-47e9-8ec7-efafb57ee1b7 Environmental → Air → Indoor EF 3.1 kg 2
c5432628-829a-4e23-a273-c1a2dce7dde9 Environmental → Air → Long-term EF 3.1 kg 0
eac131bb-c1ee-45d6-ba2b-f16492d1ca09 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
0fce5cd2-eea6-4609-a88b-b591d0ab5d8c Environmental → Air → Unknown EF 3.1 kg 2
4c908638-3885-4b38-8c28-752b55895cbe Environmental → Ground → Agricultural EF 3.1 kg 2
fa6cfee1-34a5-49bf-925b-8bfade15c68d Environmental → Ground → Non-agricultural EF 3.1 kg 2
5dafc440e730e468622f1f099404b6f602990455 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
23b092a7-7fa8-4446-abf7-6d8aea5cb8cb Environmental → Ground → Unknown EF 3.1 kg 2
7cf79d23-d0b7-4109-b6f1-d9b00a7989c2 Environmental → Water → Long-term EF 3.1 kg 0
06989be8-e140-4efe-bc38-af9515b479e4 Environmental → Water → Ocean EF 3.1 kg 2
db110efb-2a80-4bb9-bad3-672e9e8637d1 Environmental → Water → Surface water EF 3.1 kg 2
1a7c2aae-606d-4fc3-b312-37ec3ef3f5ee Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-70c79e1931752ddf",
  "prefLabel": [
    {
      "@value": "Chlorfenethol",
      "@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-Bis(4-chlorophenyl)ethan-1-ol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:80-06-8",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=80-06-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1,1-Bis(4-chlorophenyl)ethanol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=80-06-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1,1-Di(4-chlorophenyl)ethanol",
      "@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=80-06-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "4,4′-Dichloro-α-methylbenzhydrol",
      "@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=80-06-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "4-Chloro-α-(4-chlorophenyl)-α-methylbenzenemethanol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=80-06-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "BCPE",
      "@language": "en",
      "@lang": "en",
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          "https://commonchemistry.cas.org/detail?cas_rn=80-06-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "BCPE (pesticide)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=80-06-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Benzenemethanol, 4-chloro-α-(4-chlorophenyl)-α-methyl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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          "https://commonchemistry.cas.org/detail?cas_rn=80-06-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Benzhydrol, 4,4′-dichloro-α-methyl-",
      "@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=80-06-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Bis(4-chlorophenyl)methyl carbinol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Bis(p-chlorophenyl)methyl carbinol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "BPE",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "DCPC",
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      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Di(p-chlorophenyl)ethanol",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Dimit",
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          "https://commonchemistry.cas.org/detail?cas_rn=80-06-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Dimite",
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      "@lang": "en",
      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=80-06-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Micasin",
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      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=80-06-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Mikazene",
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      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Qikron",
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    },
    {
      "@value": "Quickron",
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  ],
  "properties": {
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        "C14H12Cl2O"
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      "attested_by": {
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      },
      "rdfs:label": "Molecular formula",
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        },
        {
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    },
    "https://w3id.org/chemrof/smiles_string": {
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      "rdfs:label": "SMILES",
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    "https://w3id.org/chemrof/inchi2d_string": {
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      "rdfs:label": "InChI",
      "@value": [
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      "attested_by": {
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    "https://w3id.org/chemrof/IUPAC_name": {
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