Consensus flow list

Identity

Type
NeutralMolecule
CAS
38888-98-1
EC
254-179-7
Origin
EF 3.1 hybrid_name_cas_v1
Changes
52 across every transformer

Structure

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

Alternative labels

4

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string BSZXAFXFTLXUFV-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C14H14/c1-12(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-12H,1H3
IUPAC name chemrof:IUPAC_name 1-phenylethylbenzene
Molecular formula chemrof:molecular_formula C14H14
Molecular mass chemrof:molecular_mass 182.266
Monoisotopic mass chemrof:monoisotopic_mass 182.10955
SMILES string chemrof:smiles_string CC(C1=CC=CC=C1)C2=CC=CC=C2

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=38888-98-1 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.049.237 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.219.390 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID6041218 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=33534 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/9813FDC9QO enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J22.354I enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/11918 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q9545624 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
efa8eb26-dca7-46d2-9651-ce8e860788fa Environmental → Air → Aircraft cruise height EF 3.1 kg 4
5f725ce5-ab10-42a8-803e-68c53db1314b Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
be12b8d4-fa6d-48e4-af40-b0c2f7731550 Environmental → Air → Indoor EF 3.1 kg 4
1216fd7e-4cd8-4e1e-86d5-cafbf0e25888 Environmental → Air → Long-term EF 3.1 kg 0
e9c151d8-9bfd-4501-9dec-bf4754efee8e Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
2001d2e2-04eb-4d42-b410-bb52810efe92 Environmental → Air → Unknown EF 3.1 kg 4
bdb528bf-8298-447d-a6e6-8ec0f6301f7e Environmental → Ground → Agricultural EF 3.1 kg 4
c223dcf6-7325-4b57-b95d-d053ff5c55b3 Environmental → Ground → Non-agricultural EF 3.1 kg 4
09412c13-1a61-4ffa-ab3a-f786f59b6bf1 Environmental → Ground → Unknown EF 3.1 kg 4
c432261d-978c-4378-b439-23ff8a75308f Environmental → Water → Long-term EF 3.1 kg 0
8113e6f2-3506-4d05-b36d-04d66b7467cd Environmental → Water → Ocean EF 3.1 kg 4
21a3ae0b-fdec-4636-9b35-e94d4f53f874 Environmental → Water → Surface water EF 3.1 kg 4
df835511-5bae-4223-b01a-eb91bbb4fed6 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (52 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-24a18d8350450c66",
  "prefLabel": [
    {
      "@value": "1,1'-ethane-1,1-diyldibenzene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "(Phenylethyl)benzene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Benzene, (phenylethyl)-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Diphenylethane",
      "@language": "en",
      "@lang": "en",
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    },
    {
      "@value": "Ethane, diphenyl-",
      "@language": "en",
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}

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