← Back to consensus flows

Ammonium 3-amino-2,5-dichlorobenzoate

UUID b59d5591-6fd8-4c7a-a03d-e8267f79ac10
Flow Object IDfo-02d852f2ce0148da
Source EF 3.1
Context Environmental → Air → Unknown
CAS Numbers 1076-46-6
EC Numbers 214-062-3
prefLabel
Language Value Provenance
en Ammonium 3-amino-2,5-dichlorobenzoate
altLabel
Language Value Provenance
en Amiben ammonium salt
en Benzoic acid, 3-amino-2,5-dichloro-, ammonium salt
en Benzoic acid, 3-amino-2,5-dichloro-, ammonium salt (1:1)
en Benzoic acid, 3-amino-2,5-dichloro-, monoammonium salt
en Chloramben ammonium salt
en Chloramben-ammonium
References
Shared Properties
Predicate Value
InChIKey RSSKZIYCSDAOJD-UHFFFAOYSA-N, RSSKZIYCSDAOJD-UHFFFAOYSA-O
InChI InChI=1S/C7H5Cl2NO2.H3N/c8-3-1-4(7(11)12)6(9)5(10)2-3;/h1-2H,10H2,(H,11,12);1H3, InChI=1S/C7H5Cl2NO2.H3N/c8-3-1-4(7(11)12)6(9)5(10)2-3;/h1-2H,10H2,(H,11,12);1H3/p+1
IUPAC name 3-amino-2,5-dichloro-benzoic acid;ammonia, 3-amino-2,5-dichlorobenzoic acid;ammonia, 3-amino-2,5-dichlorobenzoic acid;azane, ammonium 3-amino-2,5-dichloro-benzoate, ammonium 3-amino-2,5-dichloro-benzoic acid, ammonium 3-amino-2,5-dichlorobenzoate, ammonium 3-amino-2,5-dichlorobenzoic acid, azane;3-azanyl-2,5-bis(chloranyl)benzoic acid, azanium 3-amino-2,5-dichlorobenzoate, azanium 3-amino-2,5-dichlorobenzoic acid, azanium 3-azanyl-2,5-bis(chloranyl)benzoate, azanium 3-azanyl-2,5-bis(chloranyl)benzoic acid
Molecular formula C7H8Cl2N2O2, C7H9Cl2N2O2+
SMILES C1=C(C=C(C(=C1C(=O)O)Cl)N)Cl.N, C1=C(C=C(C(=C1C(=O)O)Cl)N)Cl.[NH4+], C1=C(C=C(C(=C1C(=O)[O-])Cl)N)Cl.[NH4+]

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 b59d5591-6fd8-4c7a-a03d-e8267f79ac10 ammonium 3-amino-2,5-dichlorobenzoate

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 ammonium 3-amino-2,5-dichlorobenzoate Emissions/Emissions to air/Emissions to air, indoor kg exactMatch

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field Change Count Latest Time Transformers Latest Comment
altLabel 1 consensus_match group_key=ammonium3-amino-2,5-dichlorobenzoate||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=1076-46-6; added Common Chemistry CAS names as altLabel: Amiben ammonium salt, Benzoic acid, 3-amino-2,5-dichloro-, ammonium salt, Benzoic acid, 3-amino-2,5-dichloro-, ammonium salt (1:1), Benzoic acid, 3-amino-2,5-dichloro-, monoammonium salt, Chloramben ammonium salt, Chloramben-ammonium; object_uuid=fo-02d852f2ce0148da
cas_match_labels 1 consensus_match group_key=ammonium3-amino-2,5-dichlorobenzoate||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory', 'pubchem']; cas_sources={'1076-46-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-02d852f2ce0148da: {'1076-46-6': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
indoorUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': 'Amiben ammonium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1076-46-6', 'https://commonchemistry.cas.org/detail?cas_rn=1076-46-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzoic acid, 3-amino-2,5-dichloro-, ammonium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1076-46-6', 'https://commonchemistry.cas.org/detail?cas_rn=1076-46-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzoic acid, 3-amino-2,5-dichloro-, ammonium salt (1:1)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1076-46-6', 'https://commonchemistry.cas.org/detail?cas_rn=1076-46-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzoic acid, 3-amino-2,5-dichloro-, monoammonium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1076-46-6', 'https://commonchemistry.cas.org/detail?cas_rn=1076-46-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Chloramben ammonium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1076-46-6', 'https://commonchemistry.cas.org/detail?cas_rn=1076-46-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Chloramben-ammonium', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1076-46-6', 'https://commonchemistry.cas.org/detail?cas_rn=1076-46-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=ammonium3-amino-2,5-dichlorobenzoate||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=1076-46-6; added Common Chemistry CAS names as altLabel: Amiben ammonium salt, Benzoic acid, 3-amino-2,5-dichloro-, ammonium salt, Benzoic acid, 3-amino-2,5-dichloro-, ammonium salt (1:1), Benzoic acid, 3-amino-2,5-dichloro-, monoammonium salt, Chloramben ammonium salt, Chloramben-ammonium; object_uuid=fo-02d852f2ce0148da
cas_match_labels None {'1076-46-6': 'exactMatch'} group_key=ammonium3-amino-2,5-dichlorobenzoate||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory', 'pubchem']; cas_sources={'1076-46-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-02d852f2ce0148da: {'1076-46-6': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

{
  "uuid": "b59d5591-6fd8-4c7a-a03d-e8267f79ac10",
  "name": null,
  "cas_numbers": [
    "1076-46-6"
  ],
  "ec_numbers": [
    "214-062-3"
  ],
  "context": {
    "dimension": "Environmental",
    "media": "Air",
    "indoor": "Unknown"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "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": 17.258
    },
    {
      "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": 17.258
    }
  ],
  "source": "EF 3.1",
  "identifier": "b59d5591-6fd8-4c7a-a03d-e8267f79ac10",
  "input_datasets": [
    "EF 3.1"
  ],
  "source_refs": [
    {
      "list_name": "EF",
      "list_version": "3.1",
      "source_flow_uuid": "b59d5591-6fd8-4c7a-a03d-e8267f79ac10",
      "source_flow_name": "ammonium 3-amino-2,5-dichlorobenzoate",
      "source_metadata": {
        "input_file": "/home/cmutel/.local/share/consensus-flow-list/ef-31-flows.json",
        "input_dataset": "EF 3.1",
        "original_context": [
          "Emissions",
          "Emissions to air",
          "Emissions to air, indoor"
        ]
      }
    }
  ],
  "prefLabel": [
    {
      "@value": "Ammonium 3-amino-2,5-dichlorobenzoate",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "_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": "enrich_references",
    "skos:definition": "enrich_references",
    "references": "enrich_references",
    "altLabel": "consensus_match",
    "cas_match_labels": "consensus_match"
  },
  "context_iri": "https://vocab.brightway.one/flow-contexts/envi-air-indr-unkn",
  "unit_iri": "https://vocab.brightway.one/units/unit/KiloGM",
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C7H8Cl2N2O2",
        "C7H9Cl2N2O2+"
      ],
      "rdfs:label": "Molecular formula",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:14102",
          "CID:57483974",
          "CID:68113353"
        ],
        "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
      }
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "RSSKZIYCSDAOJD-UHFFFAOYSA-N",
        "RSSKZIYCSDAOJD-UHFFFAOYSA-O"
      ],
      "rdfs:label": "InChIKey",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:14102",
          "CID:57483974",
          "CID:68113353"
        ],
        "prov:wasDerivedFrom": "pubchem.props.InChIKey"
      }
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "@value": [
        "C1=C(C=C(C(=C1C(=O)O)Cl)N)Cl.N",
        "C1=C(C=C(C(=C1C(=O)O)Cl)N)Cl.[NH4+]",
        "C1=C(C=C(C(=C1C(=O)[O-])Cl)N)Cl.[NH4+]"
      ],
      "rdfs:label": "SMILES",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:14102",
          "CID:57483974",
          "CID:68113353"
        ],
        "prov:wasDerivedFrom": "pubchem.props.SMILES"
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "@value": [
        "InChI=1S/C7H5Cl2NO2.H3N/c8-3-1-4(7(11)12)6(9)5(10)2-3;/h1-2H,10H2,(H,11,12);1H3",
        "InChI=1S/C7H5Cl2NO2.H3N/c8-3-1-4(7(11)12)6(9)5(10)2-3;/h1-2H,10H2,(H,11,12);1H3/p+1"
      ],
      "rdfs:label": "InChI",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:14102",
          "CID:57483974",
          "CID:68113353"
        ],
        "prov:wasDerivedFrom": "pubchem.props.InChI"
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "@value": [
        "3-amino-2,5-dichloro-benzoic acid;ammonia",
        "3-amino-2,5-dichlorobenzoic acid;ammonia",
        "3-amino-2,5-dichlorobenzoic acid;azane",
        "ammonium 3-amino-2,5-dichloro-benzoate",
        "ammonium 3-amino-2,5-dichloro-benzoic acid",
        "ammonium 3-amino-2,5-dichlorobenzoate",
        "ammonium 3-amino-2,5-dichlorobenzoic acid",
        "azane;3-azanyl-2,5-bis(chloranyl)benzoic acid",
        "azanium 3-amino-2,5-dichlorobenzoate",
        "azanium 3-amino-2,5-dichlorobenzoic acid",
        "azanium 3-azanyl-2,5-bis(chloranyl)benzoate",
        "azanium 3-azanyl-2,5-bis(chloranyl)benzoic acid"
      ],
      "rdfs:label": "IUPAC name",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:14102",
          "CID:57483974",
          "CID:68113353"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
      }
    }
  },
  "skos:definition": [],
  "references": [
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J217.196A",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:57483974;CAS:1076-46-6"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[1076-46-6]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.012.785",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:14102;CAS:1076-46-6"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[1076-46-6]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=1076-46-6",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:14102;CAS:1076-46-6"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[1076-46-6]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID7032686",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:14102;CAS:1076-46-6"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[1076-46-6]"
      }
    },
    {
      "@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/F67I3KM21M",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:14102;CAS:1076-46-6"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[1076-46-6]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/14102",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:14102;CAS:1076-46-6"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[1076-46-6]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/57483974",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:57483974;CAS:1076-46-6"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[1076-46-6]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/68113353",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:68113353;CAS:1076-46-6"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[1076-46-6]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q27277702",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:14102;CAS:1076-46-6"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[1076-46-6]"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "Amiben ammonium salt",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:1076-46-6",
          "https://commonchemistry.cas.org/detail?cas_rn=1076-46-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Benzoic acid, 3-amino-2,5-dichloro-, ammonium salt",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:1076-46-6",
          "https://commonchemistry.cas.org/detail?cas_rn=1076-46-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Benzoic acid, 3-amino-2,5-dichloro-, ammonium salt (1:1)",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:1076-46-6",
          "https://commonchemistry.cas.org/detail?cas_rn=1076-46-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Benzoic acid, 3-amino-2,5-dichloro-, monoammonium salt",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:1076-46-6",
          "https://commonchemistry.cas.org/detail?cas_rn=1076-46-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Chloramben ammonium salt",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:1076-46-6",
          "https://commonchemistry.cas.org/detail?cas_rn=1076-46-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Chloramben-ammonium",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:1076-46-6",
          "https://commonchemistry.cas.org/detail?cas_rn=1076-46-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "cas_match_labels": {
    "1076-46-6": "exactMatch"
  },
  "concept_associations": [
    {
      "@type": "xkos:ConceptAssociation",
      "xkos:sourceConcept": {
        "@id": "https://vocab.brightway.one/ef/3.1/flow/b59d5591-6fd8-4c7a-a03d-e8267f79ac10",
        "skos:prefLabel": "ammonium 3-amino-2,5-dichlorobenzoate",
        "context": "Emissions/Emissions to air/Emissions to air, indoor",
        "qudt:unit": "kg"
      },
      "xkos:targetConcept": {
        "@id": "https://vocab.brightway.dev/elementary-flows/b59d5591-6fd8-4c7a-a03d-e8267f79ac10"
      },
      "xkos:mapType": {
        "@id": "http://www.w3.org/2004/02/skos/core#exactMatch"
      },
      "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"
        ]
      }
    }
  ],
  "flow_object_id": "fo-02d852f2ce0148da"
}