Consensus flow list

Identity

Substance
fo-f3ac0f842abf5525 Neutral molecule
Source
EF 3.1
Unit
kg
Context
Environmental → Air → Long-term
CAS
422-05-9
EC
207-012-7

Context

Dimension
Environmental
Media
Air
Strata
Long-term

Alternative labels

9

Source lists

1
List Version Source flow Name there Why this flow
EF 3.1 4d9a8790-3ddd-11dd-99b3-0050c2490048 pentafluoro-1-propanol The consensus list is built from this one, so this row is the flow itself rather than something matched to it.

History

The change log and the PROV-O trail (2 consensus changes)

Open the changes page

These are the heaviest sections of this page and the least often read, so the page does not pay for them until you ask.

Full record

Flow JSON
{
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C3H3F5O"
      ],
      "attested_by": {
        "C3H3F5O": [
          "enrich_references.pubchem_semantic",
          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "Molecular formula",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:9872"
          ],
          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "OCC(F)(F)C(F)(F)F"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "PSQZJKGXDGNDFP-UHFFFAOYSA-N"
      ],
      "attested_by": {
        "PSQZJKGXDGNDFP-UHFFFAOYSA-N": [
          "enrich_references.pubchem_semantic",
          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "InChIKey",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:9872"
          ],
          "prov:wasDerivedFrom": "pubchem.props.InChIKey"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "OCC(F)(F)C(F)(F)F"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
        "OCC(F)(F)C(F)(F)F"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "1-Propanol, 2,2,3,3,3-pentafluoro-"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "OCC(F)(F)C(F)(F)F"
          ]
        },
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "2,2,3,3,3-Pentafluoropropan-1-ol"
          ]
        }
      ],
      "attested_by": {
        "OCC(F)(F)C(F)(F)F": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/C3H3F5O/c4-2(5,1-9)3(6,7)8/h9H,1H2"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "1-Propanol, 2,2,3,3,3-pentafluoro-"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "OCC(F)(F)C(F)(F)F"
          ]
        },
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "2,2,3,3,3-Pentafluoropropan-1-ol"
          ]
        }
      ],
      "attested_by": {
        "InChI=1S/C3H3F5O/c4-2(5,1-9)3(6,7)8/h9H,1H2": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "rdfs:label": "IUPAC name",
      "@value": [
        "1-Propanol, 2,2,3,3,3-pentafluoro-",
        "2,2,3,3,3-Pentafluoropropan-1-ol"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "opsin_iupac",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "1-Propanol, 2,2,3,3,3-pentafluoro-",
          "2,2,3,3,3-Pentafluoropropan-1-ol"
        ]
      },
      "attested_by": {
        "1-Propanol, 2,2,3,3,3-pentafluoro-": [
          "opsin_iupac"
        ],
        "2,2,3,3,3-Pentafluoropropan-1-ol": [
          "opsin_iupac"
        ]
      }
    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "rdfs:label": "Molecular mass",
      "@value": [
        150.046
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C(C(C(F)(F)F)(F)F)O"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "OCC(F)(F)C(F)(F)F"
          ]
        }
      ],
      "attested_by": {
        "150.046": [
          "rdkit_post_consensus",
          "rdkit_pre_consensus"
        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
      "@id": "https://w3id.org/chemrof/monoisotopic_mass",
      "rdfs:label": "Monoisotopic mass",
      "@value": [
        150.010406
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C(C(C(F)(F)F)(F)F)O"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "OCC(F)(F)C(F)(F)F"
          ]
        }
      ],
      "attested_by": {
        "150.010406": [
          "rdkit_post_consensus",
          "rdkit_pre_consensus"
        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    }
  },
  "references": [
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J43.131A",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:9872;CAS:422-05-9"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[422-05-9]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.006.376",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:9872;CAS:422-05-9"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[422-05-9]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=422-05-9",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "422-05-9"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID4059966",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:9872;CAS:422-05-9"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[422-05-9]"
      }
    },
    {
      "@id": "https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=66413",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:9872;CAS:422-05-9"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[422-05-9]"
      }
    },
    {
      "@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/EPJ1S961SN",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:9872;CAS:422-05-9"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[422-05-9]"
      }
    },
    {
      "@id": "https://hmdb.ca/metabolites/HMDB0245341",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:9872;CAS:422-05-9"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[422-05-9]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/9872",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:9872;CAS:422-05-9"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[422-05-9]"
      }
    },
    {
      "@id": "https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL4457653",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:9872;CAS:422-05-9"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[422-05-9]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q27277290",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:9872;CAS:422-05-9"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[422-05-9]"
      }
    }
  ],
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ],
  "http://www.w3.org/2004/02/skos/core#definition": [],
  "uuid": "4d9a8790-3ddd-11dd-99b3-0050c2490048",
  "identifier": "4d9a8790-3ddd-11dd-99b3-0050c2490048",
  "source": "EF 3.1",
  "cas_numbers": [
    "422-05-9"
  ],
  "ec_numbers": [
    "207-012-7"
  ],
  "context": {
    "dimension": "Environmental",
    "media": "Air",
    "strata": "Long-term"
  },
  "synonyms": [],
  "lcia_methods": [],
  "unit": "kg",
  "input_datasets": [
    "EF 3.1"
  ],
  "prefLabel": [
    {
      "@value": "2,2,3,3,3-Pentafluoropropan-1-ol",
      "@language": "en",
      "@lang": "en",
      "source": {
        "prov:wasGeneratedBy": "substance_label_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:wasDerivedFrom": "flow_object.prefLabel (fo-f3ac0f842abf5525)"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "1,1-Dihydropentafluoropropanol",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:422-05-9",
          "https://commonchemistry.cas.org/detail?cas_rn=422-05-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1,1-Dihydroperfluoropropanol",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:422-05-9",
          "https://commonchemistry.cas.org/detail?cas_rn=422-05-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1-Propanol, 2,2,3,3,3-pentafluoro-",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:422-05-9",
          "https://commonchemistry.cas.org/detail?cas_rn=422-05-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1H,1H-Pentafluoro-1-propanol",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:422-05-9",
          "https://commonchemistry.cas.org/detail?cas_rn=422-05-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1H,1H-Perfluoropropanol",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:422-05-9",
          "https://commonchemistry.cas.org/detail?cas_rn=422-05-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2,2,3,3,3-Pentafluoro-1-propanol",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:422-05-9",
          "https://commonchemistry.cas.org/detail?cas_rn=422-05-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2,2,3,3,3-Pentafluoropropanol",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:422-05-9",
          "https://commonchemistry.cas.org/detail?cas_rn=422-05-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "3,3,3,2,2-Pentafluoropropan-1-ol",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:422-05-9",
          "https://commonchemistry.cas.org/detail?cas_rn=422-05-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Pentafluoro-1-propanol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "context_iri": "https://vocab.brightway.one/flow-contexts/envi-air-lote",
  "unit_iri": "https://vocab.brightway.one/units/unit/KiloGM",
  "flow_object_id": "fo-f3ac0f842abf5525",
  "concept_associations": [],
  "http://www.w3.org/2002/07/owl#deprecated": true,
  "http://purl.org/dc/terms/isReplacedBy": "urn:uuid:7d124794-e251-11e6-bf01-fe55135034f3",
  "is_replaced_by_uuid": "7d124794-e251-11e6-bf01-fe55135034f3",
  "_sources": {
    "prefLabel": "substance_label_v1",
    "name": "bootstrap_labels",
    "synonyms": "bootstrap_labels",
    "context": "default_context_mapping",
    "context_iri": "default_context_mapping",
    "unit_iri": "unit_normalization",
    "ec_numbers": "ec_cross_check",
    "properties": "link_flows_to_their_substance",
    "skos_definition": "enrich_references",
    "references": "enrich_references",
    "altLabel": "substance_label_v1",
    "cas_match_labels": "consensus_match",
    "owl_deprecated": "pipeline.collision_decisions",
    "dcterms_is_replaced_by": "pipeline.collision_decisions",
    "is_replaced_by_uuid": "pipeline.collision_decisions",
    "types": "link_flows_to_their_substance"
  },
  "cas_match_labels": {
    "422-05-9": "exactMatch"
  },
  "general_comment": "Correct mapping CAS and flow to be verified, potentially wrong. Note that the CAS No is the relevant identifier, to which also the ILCD LCIA characterisation factors relate. Reference elementary flow of the International Reference Life Cycle Data System (ILCD).",
  "_transformed": true,
  "_provided": {
    "name": "pentafluoro-1-propanol",
    "synonyms": [
      "1,1-Dihydroperfluoropropanol",
      "1-Propanol, 2,2,3,3,3-pentafluoro-",
      "1H, 1H-PENTAFLUORO-1-PROPANOL",
      "1H,1H-Pentafluoropropanol",
      "1H,1H-Pentafluoropropanol-1",
      "2,2,3,3,3-PENTAFLUOROPROPANOL",
      "2,2,3,3,3-Pentafluoro-1-propanol",
      "2,2,3,3,3-pentafluoro-l-propanol",
      "2,2,3,3,3-pentafluoropropan-1-ol",
      "3S210836",
      "AC1L1U0G",
      "AC1Q4ICK",
      "AC1Q7BME",
      "AKOS000121412",
      "Alcohols, C3-11, beta-omega-perfluoro-omega-hydro",
      "I14-13152",
      "P0845",
      "PERFLUORODIHYDROPROPANOL",
      "PFPOH",
      "PSQZJKGXDGNDFP-UHFFFAOYSA-",
      "ST51041395",
      "TX-010530"
    ],
    "context": [
      "Emissions",
      "Emissions to air",
      "Emissions to air, unspecified (long-term)"
    ],
    "cas_numbers": [
      "422-05-9"
    ],
    "ec_numbers": [],
    "unit": "kg"
  }
}

Keyboard

?
Show or hide this map
Esc
Close

More as the sections are built.