Consensus flow list

Identity

Type
Neutral molecule
CAS
13463-40-6
EC
236-670-8
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Pentacarbonyliron

Alternative labels

7

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string FYOFOKCECDGJBF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/5CO.Fe/c5*1-2;
IUPAC name chemrof:IUPAC_name Pentacarbonyliron
Molecular formula chemrof:molecular_formula C5FeO5
Molecular mass chemrof:molecular_mass 195.895
Monoisotopic mass chemrof:monoisotopic_mass 195.90951, 195.909511
SMILES string chemrof:smiles_string O=[C]=[Fe](=[C]=O)(=[C]=O)(=[C]=O)=[C]=O

Known URLs

8

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=13463-40-6 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:30251 enrich_references.chebi_id_link
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=158658 enrich_references.pubchem_identifier_url
gmelin gmelin:3567 enrich_references.chebi_xrefs
gmelin gmelin:3568 enrich_references.chebi_xrefs
molbase molbase:49 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/518773 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q412278 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
ba82ad44-672e-4dcd-b4d2-ca070fb7723f Environmental → Air → Aircraft cruise height EF 3.1 kg 2
d4bf66f9-0a0c-474b-a7a8-dc8bd68d80dc Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
7b73017f-d6fb-4456-be2c-44f4dd311078 Environmental → Air → Indoor EF 3.1 kg 2
85e9691c-a254-4e84-aa51-71d53dd09461 Environmental → Air → Long-term EF 3.1 kg 0
999248ae-1f43-4e06-91e5-85f93cbe2eca Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
31063cd5-a1be-447f-85e6-41e6607531e5 Environmental → Air → Unknown EF 3.1 kg 2
cec34195-728a-4f87-8ace-8096a7c343f2 Environmental → Ground → Agricultural EF 3.1 kg 2
d0ac513b-0022-4e63-ac8d-ba53a3765c7b Environmental → Ground → Non-agricultural EF 3.1 kg 2
8e55588d-a3d3-4e01-8d76-fb360a4d55b4 Environmental → Ground → Unknown EF 3.1 kg 2
1a2948f3-780e-4ff7-8c92-65aefcc26f6f Environmental → Water → Long-term EF 3.1 kg 0
0ca8dce1-29a1-44e2-a360-f13105862a7e Environmental → Water → Ocean EF 3.1 kg 2
79c6a1f6-ffd6-4411-86b7-05a134791c1c Environmental → Water → Surface water EF 3.1 kg 2
3631d398-39a0-4db2-9dff-592cb1d07859 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-92ef897dc674a2ba",
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    {
      "@value": "Pentacarbonyliron",
      "@language": "en",
      "@lang": "en",
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        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "[Fe(CO)5]",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Iron carbonyl (Fe(CO)5)",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Iron carbonyl (Fe(CO)5), (TB-5-11)-",
      "@language": "en",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
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      }
    },
    {
      "@value": "Iron pentacarbonyl (Fe(CO)5)",
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}

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