Consensus flow list

Identity

Type
MolecularComplex
CAS
155041-85-3
EC
439-730-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for (trans(trans))-4'-vinyl-4-(4-methylphenyl)bicyclohexyl

Alternative labels

12

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string BCUMFFLWJNKNOU-YSXIEMCBSA-N, RCAVEWNDGWQRSP-UHFFFAOYSA-N, UHVCNSFNUQZVAL-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C19H28.C2H4/c1-16-10-12-18(13-11-16)19(14-6-3-7-15-19)17-8-4-2-5-9-17;1-2/h10-13,17H,2-9,14-15H2,1H3;1-2H2
IUPAC name chemrof:IUPAC_name 4-Methylphenyl bicyclohexyl ethylene
Molecular formula chemrof:molecular_formula C21H30, C21H32, C42H60
SMILES string chemrof:smiles_string C=C.Cc1ccc(C2(C3CCCCC3)CCCCC2)cc1

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=155041-85-3 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.103.628 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID201377503 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID80608922 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.339.174B enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.802.028G enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.781.363J enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/145066107 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/20580010 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q72471198 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
5a91e0ff-9d0f-4c50-aaa8-248b662b8603 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
091327c9-12ae-48d2-ab22-da64246625fe Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
d199e462-767c-4e03-bf13-525d4279fb60 Environmental → Air → Indoor EF 3.1 kg 4
741dd57e-bff1-4e8e-bb7e-33dc7c46c1d0 Environmental → Air → Long-term EF 3.1 kg 0
6a40fc63-7d78-44d8-a24c-592bb98cdd71 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
ff4af04a-21ce-470d-833c-447b918e6b6b Environmental → Air → Unknown EF 3.1 kg 4
a569856e-632b-4a46-b533-2254a77feadc Environmental → Ground → Agricultural EF 3.1 kg 4
20aa16c3-7c70-4ac1-82e1-e0ec0880649e Environmental → Ground → Non-agricultural EF 3.1 kg 4
c25eebec-2e21-47b0-b47a-aad712605b4c Environmental → Ground → Unknown EF 3.1 kg 4
417472c0-2850-4ce1-84de-59963f92b696 Environmental → Water → Long-term EF 3.1 kg 0
5c3f3201-98cf-449c-82a9-89f416caa9b7 Environmental → Water → Ocean EF 3.1 kg 4
e15cafe2-9cd9-4967-9b53-7308a2b477ac Environmental → Water → Surface water EF 3.1 kg 4
87fe396a-93d8-42e0-ab4d-c0c8d1fd6c52 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-a2b6759d001293b0",
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    {
      "@value": "(trans(trans))-4'-vinyl-4-(4-methylphenyl)bicyclohexyl",
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      }
    }
  ],
  "altLabel": [
    {
      "@value": "(trans,trans)-4-Ethenyl-4′-(4-methylphenyl)-1,1′-bicyclohexane",
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      "@lang": "en",
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    {
      "@value": "(trans,trans)-4-Ethenyl-4′-(4-methylphenyl)-1,1′-bicyclohexyl",
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      "@value": "1-[(trans,trans)-4′-Ethenyl[1,1′-bicyclohexyl]-4-yl]-4-methylbenzene",
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      "@value": "Benzene, 1-[(trans,trans)-4′-ethenyl[1,1′-bicyclohexyl]-4-yl]-4-methyl-",
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  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/MolecularComplex"
  ]
}

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