Consensus flow list

Identity

Type
NeutralMolecule
CAS
530-48-3
EC
208-482-6
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 1,1'-ethene-1,1-diyldibenzene

Alternative labels

11

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string ZMYIIHDQURVDRB-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C14H12/c1-12(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11H,1H2
IUPAC name chemrof:IUPAC_name 1,1'-ethene-1,1-diyldibenzene
Molecular formula chemrof:molecular_formula C14H12
Molecular mass chemrof:molecular_mass 180.25
Monoisotopic mass chemrof:monoisotopic_mass 180.0939
SMILES string chemrof:smiles_string C=C(c1ccccc1)c1ccccc1

Known URLs

9

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=530-48-3 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.007.712 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID5060190 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=57645 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/BX0L5B6LLL enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J6.702D enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/10740 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27274933 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/1,1-Diphenylethylene enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
5db15a24-6e37-4ed5-965a-c0ff7ab437a4 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
821bf02f-9a9f-4f8e-a7d3-2b88afd5f4aa Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
144b5ec0-4ce0-4365-9c2e-4ed0403ccd5b Environmental → Air → Indoor EF 3.1 kg 2
e1dab2b7-66bc-492d-9a5b-d9df154c3b4e Environmental → Air → Long-term EF 3.1 kg 0
59c196b5-a9ef-481a-bfb4-cb9f0a08826d Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
b27b9ac3-38e0-44a3-a3e1-2c3929041895 Environmental → Air → Unknown EF 3.1 kg 2
1218cd1c-cfe0-4fb5-ba33-600c7e442575 Environmental → Ground → Agricultural EF 3.1 kg 2
07807ee7-8ead-47ef-a857-4fd522097627 Environmental → Ground → Non-agricultural EF 3.1 kg 2
305c3123-57d0-4231-a973-7e2d99345247 Environmental → Ground → Unknown EF 3.1 kg 2
a0e0bb3b-2375-4bec-8279-2683d604bd77 Environmental → Water → Long-term EF 3.1 kg 0
6b3a5007-6994-445a-a1df-2f3ef6a25c08 Environmental → Water → Ocean EF 3.1 kg 2
e80aefd3-df12-464f-ae4e-7919a90701e7 Environmental → Water → Surface water EF 3.1 kg 2
02673a51-e4a7-4fff-b90c-088e85cd4cb3 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-ac1c6edc5e76f175",
  "prefLabel": [
    {
      "@value": "1,1'-ethene-1,1-diyldibenzene",
      "@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-Diphenylethene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=530-48-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1,1-Diphenylethylene",
      "@language": "en",
      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1,1′-Ethenylidenebis[benzene]",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1-Phenylethenylbenzene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=530-48-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Benzene, 1,1′-ethenylidenebis-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Ethene-1,1-diyldibenzene",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Ethylene, 1,1-diphenyl-",
      "@language": "en",
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        ],
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      }
    },
    {
      "@value": "unsym-Diphenylethylene",
      "@language": "en",
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        ],
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      }
    },
    {
      "@value": "α,α-Diphenylethylene",
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    },
    {
      "@value": "α-Methylenediphenylmethane",
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    },
    {
      "@value": "α-Phenylstyrene",
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}

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