2-bromo-1,1,1-trifluoroethane

Substance: fo-f9395b6ddd22a915 Neutral molecule
Source: EF 3.1
Unit: kg
Context: Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)
CAS: 421-06-7
EC: 207-001-7
Dimension: Environmental
Media: Air
Population density: Rural (<1000 people/square mile)
Strata: Medium stack, <150 meters
1,1,1-Trifluoro-2-bromoethane
1-Bromo-2,2,2-trifluoroethane
2,2,2-Trifluoroethyl bromide
2-Bromo-trifluoroethane
Ethane, 2-bromo-1,1,1-trifluoro-
HBFC 133aB1
List	Version	Source flow	Name there	Why this flow
EF	3.1	fe0acd60-3ddc-11dd-a0fb-0050c2490048	2-bromo-1,1,1-trifluoroethane	The consensus list is built from this one, so this row is the flow itself rather than something matched to it.
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.
Flow JSON
{
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C2H2BrF3"
      ],
      "attested_by": {
        "C2H2BrF3": [
          "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:67898"
          ],
          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "FC(F)(F)CBr"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "TZNJHEHAYZJBHR-UHFFFAOYSA-N"
      ],
      "attested_by": {
        "TZNJHEHAYZJBHR-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:67898"
          ],
          "prov:wasDerivedFrom": "pubchem.props.InChIKey"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "FC(F)(F)CBr"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
        "FC(F)(F)CBr"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "2-bromo-1,1,1-trifluoroethane"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "FC(F)(F)CBr"
          ]
        },
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "1,1,1-Trifluoro-2-bromoethane"
          ]
        }
      ],
      "attested_by": {
        "FC(F)(F)CBr": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/C2H2BrF3/c3-1-2(4,5)6/h1H2"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "2-bromo-1,1,1-trifluoroethane"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "FC(F)(F)CBr"
          ]
        },
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "1,1,1-Trifluoro-2-bromoethane"
          ]
        }
      ],
      "attested_by": {
        "InChI=1S/C2H2BrF3/c3-1-2(4,5)6/h1H2": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "rdfs:label": "IUPAC name",
      "@value": [
        "2-bromo-1,1,1-trifluoroethane",
        "1,1,1-Trifluoro-2-bromoethane"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "opsin_iupac",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "2-bromo-1,1,1-trifluoroethane",
          "1,1,1-Trifluoro-2-bromoethane"
        ]
      },
      "attested_by": {
        "2-bromo-1,1,1-trifluoroethane": [
          "opsin_iupac"
        ],
        "1,1,1-Trifluoro-2-bromoethane": [
          "opsin_iupac"
        ]
      }
    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "rdfs:label": "Molecular mass",
      "@value": [
        162.936
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C(C(F)(F)F)Br"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "FC(F)(F)CBr"
          ]
        }
      ],
      "attested_by": {
        "162.936": [
          "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": [
        161.929197
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C(C(F)(F)F)Br"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "FC(F)(F)CBr"
          ]
        }
      ],
      "attested_by": {
        "161.929197": [
          "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=J150.049J",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:67898;CAS:421-06-7"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[421-06-7]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.006.366",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:67898;CAS:421-06-7"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[421-06-7]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=30283-91-1",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:67898;CAS:421-06-7"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[421-06-7]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=421-06-7",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:67898;CAS:421-06-7"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[421-06-7]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID2074324",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:67898;CAS:421-06-7"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[421-06-7]"
      }
    },
    {
      "@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/8L33M92UWM",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:67898;CAS:421-06-7"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[421-06-7]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/67898",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:67898;CAS:421-06-7"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[421-06-7]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q27270694",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:67898;CAS:421-06-7"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[421-06-7]"
      }
    }
  ],
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ],
  "http://www.w3.org/2004/02/skos/core#definition": [],
  "uuid": "fe0acd60-3ddc-11dd-a0fb-0050c2490048",
  "identifier": "fe0acd60-3ddc-11dd-a0fb-0050c2490048",
  "source": "EF 3.1",
  "cas_numbers": [
    "421-06-7"
  ],
  "ec_numbers": [
    "207-001-7"
  ],
  "context": {
    "dimension": "Environmental",
    "media": "Air",
    "strata": "Medium stack, <150 meters",
    "population_density": "Rural (<1000 people/square mile)"
  },
  "synonyms": [],
  "lcia_methods": [],
  "unit": "kg",
  "input_datasets": [
    "EF 3.1"
  ],
  "prefLabel": [
    {
      "@value": "2-bromo-1,1,1-trifluoroethane",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "1,1,1-Trifluoro-2-bromoethane",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:421-06-7",
          "https://commonchemistry.cas.org/detail?cas_rn=421-06-7"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1-Bromo-2,2,2-trifluoroethane",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:421-06-7",
          "https://commonchemistry.cas.org/detail?cas_rn=421-06-7"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2,2,2-Trifluoroethyl bromide",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:421-06-7",
          "https://commonchemistry.cas.org/detail?cas_rn=421-06-7"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Bromo-trifluoroethane",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:421-06-7",
          "https://commonchemistry.cas.org/detail?cas_rn=421-06-7"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Ethane, 2-bromo-1,1,1-trifluoro-",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:421-06-7",
          "https://commonchemistry.cas.org/detail?cas_rn=421-06-7"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "HBFC 133aB1",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:421-06-7",
          "https://commonchemistry.cas.org/detail?cas_rn=421-06-7"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "context_iri": "https://vocab.brightway.one/flow-contexts/envi-air-mest15me-ru10pesq",
  "unit_iri": "https://vocab.brightway.one/units/unit/KiloGM",
  "flow_object_id": "fo-f9395b6ddd22a915",
  "concept_associations": [],
  "http://www.w3.org/2002/07/owl#deprecated": true,
  "http://purl.org/dc/terms/isReplacedBy": "urn:uuid:930864fc-e251-11e6-bf01-fe55135034f3",
  "is_replaced_by_uuid": "930864fc-e251-11e6-bf01-fe55135034f3",
  "_sources": {
    "prefLabel": "bootstrap_labels",
    "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": "consensus_match",
    "cas_match_labels": "consensus_match",
    "owl_deprecated": "pipeline.deduplication",
    "dcterms_is_replaced_by": "pipeline.deduplication",
    "is_replaced_by_uuid": "pipeline.deduplication",
    "types": "link_flows_to_their_substance"
  },
  "cas_match_labels": {
    "421-06-7": "exactMatch"
  },
  "_transformed": true,
  "_provided": {
    "name": "2-bromo-1,1,1-trifluoroethane",
    "synonyms": [
      "2,2,2-Trifluoroethyl bromide",
      "AC1L28KW",
      "AC1Q27KP",
      "Bromotrifluoroethane",
      "Ethane, 2-bromo-1,1,1-trifluoro-",
      "FT-0081255",
      "Trifluorobromoethane"
    ],
    "context": [
      "Emissions",
      "Emissions to air",
      "Emissions to non-urban air or from high stacks"
    ],
    "cas_numbers": [
      "421-06-7"
    ],
    "ec_numbers": [],
    "unit": "kg"
  }
}
2-bromo-1,1,1-trifluoroethane

Identity

Context

Alternative labels

Source lists

History

Full record

Keyboard
