Consensus flow list

Identity

Type
Neutral molecule
CAS
112-95-8
EC
204-018-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Icosane

Alternative labels

5

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string CBFCDTFDPHXCNY-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C20H42/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3-20H2,1-2H3
IUPAC name chemrof:IUPAC_name Icosane
Molecular formula chemrof:molecular_formula C20H42
Molecular mass chemrof:molecular_mass 282.556
Monoisotopic mass chemrof:monoisotopic_mass 282.32865, 282.328651
SMILES string chemrof:smiles_string CCCCCCCCCCCCCCCCCCCC

Known URLs

20

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
beilstein beilstein:1700722 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=112-95-8 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:43619 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.003.653 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID1025227 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=62789 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/3AYA9KEC48 enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0059909 enrich_references.chebi_xrefs
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.999B enrich_references.pubchem_identifier_url
lipidmaps.org https://lipidmaps.org/databases/lmsd/LMFA11000571 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=5266 enrich_references.pubchem_identifier_url
pdb-ccd pdb-ccd:LFA enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/8222 enrich_references.pubchem_compound
PubMed https://pubmed.ncbi.nlm.nih.gov/23459067 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23880873 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23899195 enrich_references.chebi_xrefs
reaxys reaxys:1700722 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q150925 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Eicosane enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Icosane enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
2d5b4977-0ffe-48cd-8428-990c5ee76836 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
713766c2-1b18-44d3-b055-f0a20e271360 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
489e57eb-55fc-4222-8abc-c3a42defd3ad Environmental → Air → Indoor EF 3.1 kg 4
ce135596-fb49-47ac-b035-98d1a6b37acd Environmental → Air → Long-term EF 3.1 kg 0
b100c26e-97af-427d-8f32-9b880b530ed4 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
e5ecc801-a4b6-4061-b595-b86cf4c0a1ab Environmental → Air → Unknown EF 3.1 kg 4
5d81b702-3b3a-4f16-883b-b2e5cfc2d3e1 Environmental → Ground → Agricultural EF 3.1 kg 4
dfc24d64-1689-40c8-8d27-a851b54ad626 Environmental → Ground → Non-agricultural EF 3.1 kg 4
1b62c0e7-033a-4d46-8054-31594eda3702 Environmental → Ground → Unknown EF 3.1 kg 4
d0fc13f6-eba9-4bc1-8ae7-593cdfc1243c Environmental → Water → Long-term EF 3.1 kg 0
3c9befe8-48ee-45aa-bc9f-8b84c3623680 Environmental → Water → Ocean EF 3.1 kg 4
05782dca-46ea-4505-997a-39f251c47d4c Environmental → Water → Surface water EF 3.1 kg 4
5dda000d-4ddf-49ec-ad5c-256535a59905 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-f1a2ecda66bc6f8f",
  "prefLabel": [
    {
      "@value": "Icosane",
      "@language": "en",
      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "CH3-[CH2]18-CH3",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "EICOSANE",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "n-eicosane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "octyldodecane",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Parafol 20Z",
      "@language": "en",
      "@lang": "en",
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}

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