2,2-dimethylpropan-1-ol, Tribromo Derivative

Substance: fo-49afdaaa45bad978 Neutral molecule
Source: EF 3.1
Unit: kg
Context: Environmental → Air → Ground level → Urban (>1000 people/square mile)
CAS: 36483-57-5
EC: 253-057-0

Dimension: Environmental
Media: Air
Population density: Urban (>1000 people/square mile)
Strata: Ground level

1-Propanol, 2,2-dimethyl-, tribromo deriv.
Tribromoneopentyl alcohol

List	Version	Source flow	Name there	Why this flow
EF	3.1	f4554f37-2255-4811-a938-401e58776b89	2,2-dimethylpropan-1-ol, tribromo derivative	The consensus list is built from this one, so this row is the flow itself rather than something matched to it.

Source list	Source flow	Name there	Compartment there	Match	Conversion
EF 3.1	f4554f37-2255-4811-a938-401e58776b89	2,2-dimethylpropan-1-ol, tribromo derivative	Emissions/Emissions to air/Emissions to urban air close to ground	exactMatch	—

consensus-flow-list 2
European Commission — JRC 2

Every implementation that says anything about this flow. Published as is what this list did with the row: where more than one implementation states a number and they agree it publishes it as agreed; where only one speaks, as sole; where they disagree it publishes nothing and asks.

Method	Implementation	Category	Place	Factor	Published as
EF 3.1	European Commission — JRC	Ecotoxicity, freshwater	—	1,446	—
EF 3.1	consensus-flow-list	Ecotoxicity, freshwater	—	1,446	sole
EF 3.1	European Commission — JRC	Ecotoxicity, freshwater_organics	—	1,446	—
EF 3.1	consensus-flow-list	Ecotoxicity, freshwater_organics	—	1,446	sole

This flow in the difference report

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

{
  "altLabel": [
    {
      "@value": "1-Propanol, 2,2-dimethyl-, tribromo deriv.",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:36483-57-5",
          "https://commonchemistry.cas.org/detail?cas_rn=36483-57-5"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Tribromoneopentyl alcohol",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:36483-57-5",
          "https://commonchemistry.cas.org/detail?cas_rn=36483-57-5"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C5H9Br3O"
      ],
      "attested_by": {
        "C5H9Br3O": [
          "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:15206"
          ],
          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC(C)(CBr)C(O)(Br)Br"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "HFRIZVDRQKQDRM-UHFFFAOYSA-N",
        "QEJPOEGPNIVDMK-UHFFFAOYSA-N"
      ],
      "attested_by": {
        "QEJPOEGPNIVDMK-UHFFFAOYSA-N": [
          "enrich_references.pubchem_semantic"
        ],
        "HFRIZVDRQKQDRM-UHFFFAOYSA-N": [
          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "InChIKey",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:15206"
          ],
          "prov:wasDerivedFrom": "pubchem.props.InChIKey"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC(C)(CBr)C(O)(Br)Br"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
        "CC(C)(CBr)C(O)(Br)Br"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "Tribromoneopentyl alcohol"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC(C)(CBr)C(O)(Br)Br"
          ]
        }
      ],
      "attested_by": {
        "CC(C)(CBr)C(O)(Br)Br": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/C5H9Br3O/c1-4(2,3-6)5(7,8)9/h9H,3H2,1-2H3"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "Tribromoneopentyl alcohol"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC(C)(CBr)C(O)(Br)Br"
          ]
        }
      ],
      "attested_by": {
        "InChI=1S/C5H9Br3O/c1-4(2,3-6)5(7,8)9/h9H,3H2,1-2H3": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "rdfs:label": "IUPAC name",
      "@value": [
        "Tribromoneopentyl alcohol"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "opsin_iupac",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "Tribromoneopentyl alcohol"
        ]
      },
      "attested_by": {
        "Tribromoneopentyl alcohol": [
          "opsin_iupac"
        ]
      }
    }
  },
  "references": [
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J111.581B",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:15206;CAS:36483-57-5"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36483-57-5]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.151.139",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:15206;CAS:36483-57-5"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36483-57-5]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=36483-57-5",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:15206;CAS:36483-57-5"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36483-57-5]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID9024641",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:15206;CAS:36483-57-5"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36483-57-5]"
      }
    },
    {
      "@id": "https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=20521",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:15206;CAS:36483-57-5"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36483-57-5]"
      }
    },
    {
      "@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/8HZ2FQ3KUC",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:15206;CAS:36483-57-5"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36483-57-5]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/15206",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:15206;CAS:36483-57-5"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[36483-57-5]"
      }
    },
    {
      "@id": "https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1497987",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:15206;CAS:36483-57-5"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36483-57-5]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q72452018",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:15206;CAS:36483-57-5"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36483-57-5]"
      }
    }
  ],
  "prefLabel": [
    {
      "@value": "2,2-dimethylpropan-1-ol, Tribromo Derivative",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ],
  "http://www.w3.org/2004/02/skos/core#definition": [],
  "uuid": "f4554f37-2255-4811-a938-401e58776b89",
  "identifier": "f4554f37-2255-4811-a938-401e58776b89",
  "source": "EF 3.1",
  "cas_numbers": [
    "36483-57-5"
  ],
  "ec_numbers": [
    "253-057-0"
  ],
  "context": {
    "dimension": "Environmental",
    "media": "Air",
    "strata": "Ground level",
    "population_density": "Urban (>1000 people/square mile)"
  },
  "synonyms": [],
  "lcia_methods": [
    {
      "method_uuid": "05316e7a-b254-4bea-9cf0-6bf33eb5c630",
      "name": "Ecotoxicity, freshwater",
      "methodology": "Environmental Footprint",
      "impact_category": "Aquatic eco-toxicity",
      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
      "characterization_factor": 1446.0
    },
    {
      "method_uuid": "fd530f00-9325-424a-92ef-aaac67922fd9",
      "name": "Ecotoxicity, freshwater_organics",
      "methodology": "Environmental Footprint",
      "impact_category": "Aquatic eco-toxicity",
      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
      "characterization_factor": 1446.0
    }
  ],
  "unit": "kg",
  "input_datasets": [
    "EF 3.1"
  ],
  "context_iri": "https://vocab.brightway.one/flow-contexts/envi-air-grle-ur10pesq",
  "unit_iri": "https://vocab.brightway.one/units/unit/KiloGM",
  "flow_object_id": "fo-49afdaaa45bad978",
  "concept_associations": [
    {
      "@type": "xkos:ConceptAssociation",
      "xkos:sourceConcept": {
        "@id": "https://vocab.brightway.one/ef/3.1/flow/f4554f37-2255-4811-a938-401e58776b89",
        "skos:prefLabel": "2,2-dimethylpropan-1-ol, tribromo derivative",
        "context": "Emissions/Emissions to air/Emissions to urban air close to ground",
        "qudt:hasUnit": {
          "@id": "https://vocab.brightway.one/units/unit/KiloGM"
        },
        "skos:exactMatch": {
          "@id": "https://vocab.brightway.dev/elementary-flows/f4554f37-2255-4811-a938-401e58776b89"
        }
      },
      "xkos:targetConcept": {
        "@id": "https://vocab.brightway.dev/elementary-flows/f4554f37-2255-4811-a938-401e58776b89"
      },
      "provenance": {
        "prov:wasGeneratedBy": "build_concept_associations",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "https://eplca.jrc.ec.europa.eu/permalink/EF3_1/EF-v3.1.zip"
        ]
      }
    }
  ],
  "_sources": {
    "prefLabel": "normalize_name_case",
    "name": "bootstrap_labels",
    "synonyms": "bootstrap_labels",
    "context": "default_context_mapping",
    "context_iri": "default_context_mapping",
    "unit_iri": "unit_normalization",
    "properties": "withhold_ambiguous_mass",
    "skos_definition": "enrich_references",
    "references": "enrich_references",
    "altLabel": "consensus_match",
    "cas_match_labels": "consensus_match",
    "concept_associations": "carry_associations_onto_flows",
    "types": "link_flows_to_their_substance"
  },
  "cas_match_labels": {
    "36483-57-5": "exactMatch"
  },
  "_transformed": true,
  "_provided": {
    "name": "2,2-dimethylpropan-1-ol, tribromo derivative",
    "synonyms": [
      "organic",
      "2,2-dimethylpropan-1-ol,tribromoderivative",
      "fr-513"
    ],
    "context": [
      "Emissions",
      "Emissions to air",
      "Emissions to urban air close to ground"
    ],
    "cas_numbers": [
      "36483-57-5"
    ],
    "ec_numbers": [
      "253-057-0"
    ],
    "unit": "kg"
  }
}

2,2-dimethylpropan-1-ol, Tribromo Derivative

Identity

Context

Alternative labels

Source lists

Concept associations

Characterisation factors

History

Full record

Keyboard