Consensus flow list

Identity

Type
NeutralMolecule
CAS
406-58-6
EC
Origin
EF 3.1 hybrid_name_cas_v1
Changes
51 across every transformer

Structure

Structure diagram for 1,1,1,3,3-Pentafluorobutane

Alternative labels

13

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string WZLFPVPRZGTCKP-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C4H5F5/c1-3(5,6)2-4(7,8)9/h2H2,1H3
IUPAC name chemrof:IUPAC_name 1,1,1,3,3-Pentafluorobutane
Molecular formula chemrof:molecular_formula C4H5F5
Molecular mass chemrof:molecular_mass 148.074
Monoisotopic mass chemrof:monoisotopic_mass 148.031141
SMILES string chemrof:smiles_string CC(F)(F)CC(F)(F)F

Known URLs

7

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=406-58-6 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.102.859 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.120.150 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID5073901 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J712.354J enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/67884 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q2249494 enrich_references.pubchem_identifier_url

Elementary flows

12
Flow Context Source Unit CFs
04206e6a-6556-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
fe0acd60-3ddc-11dd-ad56-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
fe0acd60-3ddc-11dd-ad55-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 2
fe0acd60-3ddc-11dd-ad57-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
fe0acd60-3ddc-11dd-ad54-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 2
04206e68-6556-11dd-ad8b-0800200c9a66 Environmental → Ground → Agricultural EF 3.1 kg 0
04206e6b-6556-11dd-ad8b-0800200c9a66 Environmental → Ground → Non-agricultural EF 3.1 kg 0
04206e6d-6556-11dd-ad8b-0800200c9a66 Environmental → Ground → Unknown EF 3.1 kg 0
04206e6f-6556-11dd-ad8b-0800200c9a66 Environmental → Water → Long-term EF 3.1 kg 0
04206e6c-6556-11dd-ad8b-0800200c9a66 Environmental → Water → Ocean EF 3.1 kg 0
04206e69-6556-11dd-ad8b-0800200c9a66 Environmental → Water → Surface water EF 3.1 kg 0
04206e6e-6556-11dd-ad8b-0800200c9a66 Environmental → Water → Unknown EF 3.1 kg 0

History

Everything that changed this substance (51 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-fb35be433c3135f2",
  "prefLabel": [
    {
      "@value": "1,1,1,3,3-Pentafluorobutane",
      "@language": "en",
      "@lang": "en",
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        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "2,2,4,4,4-Pentafluorobutane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=406-58-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "365fa",
      "@language": "en",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "365mfc",
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      }
    },
    {
      "@value": "Butane, 1,1,1,3,3-pentafluoro-",
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    },
    {
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    },
    {
      "@value": "HCFC 365mfc",
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    },
    {
      "@value": "HFC 365mfe",
      "@language": "en",
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    },
    {
      "@value": "HFC-365mfc",
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    },
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    },
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    },
    {
      "@value": "Solkane HFC 365mfc",
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}

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