2-aminotoluene Hydrochloride

Substance: fo-7523d4e2ca240919 Molecular complex
Source: EF 3.1
Unit: kg
Context: Environmental → Water → Unknown
CAS: 636-21-5
EC: 211-252-8

Dimension: Environmental
Media: Water
Water body: Unknown

2-Methylaniline hydrochloride
2-Methylbenzenamine hydrochloride
2-Methylphenylammonium chloride
o-Methylaniline hydrochloride
o-Toluidine, hydrochloride
o-Toluidinium chloride
Benzenamine, 2-methyl-, hydrochloride
Benzenamine, 2-methyl-, hydrochloride (1:1)

List	Version	Source flow	Name there	Why this flow
EF	3.1	08a91e70-3ddc-11dd-9bf6-0050c2490048	2-aminotoluene hydrochloride	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	08a91e70-3ddc-11dd-9bf6-0050c2490048	2-aminotoluene hydrochloride	Emissions/Emissions to water/Emissions to water, unspecified	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	Human toxicity, cancer	—	4.6398e-07	—
EF 3.1	consensus-flow-list	Human toxicity, cancer	—	4.6398e-07	sole
EF 3.1	European Commission — JRC	Human toxicity, cancer_organics	—	4.6398e-07	—
EF 3.1	consensus-flow-list	Human toxicity, cancer_organics	—	4.6398e-07	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": "2-Methylaniline hydrochloride",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:636-21-5",
          "https://commonchemistry.cas.org/detail?cas_rn=636-21-5"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Methylbenzenamine hydrochloride",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:636-21-5",
          "https://commonchemistry.cas.org/detail?cas_rn=636-21-5"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Methylphenylammonium chloride",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:636-21-5",
          "https://commonchemistry.cas.org/detail?cas_rn=636-21-5"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "o-Methylaniline hydrochloride",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:636-21-5",
          "https://commonchemistry.cas.org/detail?cas_rn=636-21-5"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "o-Toluidine, hydrochloride",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:636-21-5",
          "https://commonchemistry.cas.org/detail?cas_rn=636-21-5"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "o-Toluidinium chloride",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:636-21-5",
          "https://commonchemistry.cas.org/detail?cas_rn=636-21-5"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Benzenamine, 2-methyl-, hydrochloride",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:636-21-5",
          "https://commonchemistry.cas.org/detail?cas_rn=636-21-5"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Benzenamine, 2-methyl-, hydrochloride (1:1)",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:636-21-5",
          "https://commonchemistry.cas.org/detail?cas_rn=636-21-5"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C7H10ClN"
      ],
      "attested_by": {
        "C7H10ClN": [
          "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:12484",
            "CID:11171041"
          ],
          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "Cc1ccccc1N.Cl"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "OGVXWEOZQMAAIM-UHFFFAOYSA-N"
      ],
      "attested_by": {
        "OGVXWEOZQMAAIM-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:12484",
            "CID:11171041"
          ],
          "prov:wasDerivedFrom": "pubchem.props.InChIKey"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "Cc1ccccc1N.Cl"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
        "Cc1ccccc1N.Cl"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "2-aminotoluene Hydrochloride"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "Cc1ccccc1N.Cl"
          ]
        }
      ],
      "attested_by": {
        "Cc1ccccc1N.Cl": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/C7H9N.ClH/c1-6-4-2-3-5-7(6)8;/h2-5H,8H2,1H3;1H"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "2-aminotoluene Hydrochloride"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "Cc1ccccc1N.Cl"
          ]
        }
      ],
      "attested_by": {
        "InChI=1S/C7H9N.ClH/c1-6-4-2-3-5-7(6)8;/h2-5H,8H2,1H3;1H": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "rdfs:label": "IUPAC name",
      "@value": [
        "2-aminotoluene Hydrochloride"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "opsin_iupac",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "2-aminotoluene Hydrochloride"
        ]
      },
      "attested_by": {
        "2-aminotoluene Hydrochloride": [
          "opsin_iupac"
        ]
      }
    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "rdfs:label": "Molecular mass",
      "@value": [
        143.617
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC1=CC=CC=C1N.Cl"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "Cc1ccccc1N.Cl"
          ]
        }
      ],
      "attested_by": {
        "143.617": [
          "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": [
        143.050177
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC1=CC=CC=C1N.Cl"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "Cc1ccccc1N.Cl"
          ]
        }
      ],
      "attested_by": {
        "143.050177": [
          "rdkit_post_consensus",
          "rdkit_pre_consensus"
        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    }
  },
  "references": [
    {
      "@id": "https://chem.echa.europa.eu/100.010.230",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:12484;CAS:636-21-5"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[636-21-5]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=22006-17-3",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:12484;CAS:636-21-5"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[636-21-5]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=636-21-5",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:11171041;CAS:636-21-5"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[636-21-5]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID7021364",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:12484;CAS:636-21-5"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[636-21-5]"
      }
    },
    {
      "@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/DX2X117B81",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:12484;CAS:636-21-5"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[636-21-5]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/11171041",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:11171041;CAS:636-21-5"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[636-21-5]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/12484",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:12484;CAS:636-21-5"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[636-21-5]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/erg/#3077",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:12484;CAS:636-21-5"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[636-21-5]"
      }
    },
    {
      "@id": "https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1579403",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:12484;CAS:636-21-5"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[636-21-5]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q27276653",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:12484;CAS:636-21-5"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[636-21-5]"
      }
    }
  ],
  "prefLabel": [
    {
      "@value": "2-aminotoluene Hydrochloride",
      "@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/MolecularComplex"
  ],
  "http://www.w3.org/2004/02/skos/core#definition": [],
  "uuid": "08a91e70-3ddc-11dd-9bf6-0050c2490048",
  "identifier": "08a91e70-3ddc-11dd-9bf6-0050c2490048",
  "source": "EF 3.1",
  "cas_numbers": [
    "636-21-5"
  ],
  "ec_numbers": [
    "211-252-8"
  ],
  "context": {
    "dimension": "Environmental",
    "media": "Water",
    "water_body": "Unknown"
  },
  "synonyms": [],
  "lcia_methods": [
    {
      "method_uuid": "2299222a-bbd8-474f-9d4f-4dd1f18aea7c",
      "name": "Human toxicity, cancer",
      "methodology": "Environmental Footprint",
      "impact_category": "Cancer human health effects",
      "impact_indicator": "Comparative Toxic Unit for human (CTUh) ",
      "characterization_factor": 4.6398e-7
    },
    {
      "method_uuid": "503699e0-eca9-4089-8bf8-e0f49c93e578",
      "name": "Human toxicity, cancer_organics",
      "methodology": "Environmental Footprint",
      "impact_category": "Cancer human health effects",
      "impact_indicator": "Comparative Toxic Unit for human (CTUh) ",
      "characterization_factor": 4.6398e-7
    }
  ],
  "unit": "kg",
  "input_datasets": [
    "EF 3.1"
  ],
  "context_iri": "https://vocab.brightway.one/flow-contexts/envi-wate-unkn",
  "unit_iri": "https://vocab.brightway.one/units/unit/KiloGM",
  "flow_object_id": "fo-7523d4e2ca240919",
  "concept_associations": [
    {
      "@type": "xkos:ConceptAssociation",
      "xkos:sourceConcept": {
        "@id": "https://vocab.brightway.one/ef/3.1/flow/08a91e70-3ddc-11dd-9bf6-0050c2490048",
        "skos:prefLabel": "2-aminotoluene hydrochloride",
        "context": "Emissions/Emissions to water/Emissions to water, unspecified",
        "qudt:hasUnit": {
          "@id": "https://vocab.brightway.one/units/unit/KiloGM"
        },
        "skos:exactMatch": {
          "@id": "https://vocab.brightway.dev/elementary-flows/08a91e70-3ddc-11dd-9bf6-0050c2490048"
        }
      },
      "xkos:targetConcept": {
        "@id": "https://vocab.brightway.dev/elementary-flows/08a91e70-3ddc-11dd-9bf6-0050c2490048"
      },
      "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": "normalise_property_values",
    "skos_definition": "enrich_references",
    "references": "enrich_references",
    "altLabel": "dedupe_altlabels",
    "cas_match_labels": "consensus_match",
    "concept_associations": "carry_associations_onto_flows",
    "types": "link_flows_to_their_substance"
  },
  "cas_match_labels": {
    "636-21-5": "exactMatch"
  },
  "general_comment": "Correct mapping CAS and flow to be verified: yet unclear whether this is the sodium-, hydrochloride-, calcium-, potassium- or other salt or the pure substance that is emitted. 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": "2-aminotoluene hydrochloride",
    "synonyms": [
      "050934",
      "1-Amino-2-methylbenzene",
      "1-Methyl-2-aminobenzene",
      "2-AMINOTOLUENE",
      "2-Amino-1-methylbenzene",
      "2-Aminotoluene",
      "2-Aminotoluene (o-toluidine)",
      "2-Methyl-1-aminobenzene",
      "2-Methylaniline",
      "2-Methylbenzamine",
      "2-Methylbenzenamine",
      "2-Toluidine",
      "AB1002896",
      "AC1L1OBS",
      "AC1Q2FL2",
      "AKOS000119109",
      "Aniline, 2-methyl-",
      "BB_SC-7050",
      "Benzenamine, 2-methyl-",
      "C.I. 37077",
      "SMR001370921",
      "T0299",
      "o-Aminotoluene",
      "o-Methylaniline",
      "o-Methylbenzenamine",
      "o-Toluidin",
      "o-Toluidine",
      "o-Toluidyna",
      "o-Tolylamine"
    ],
    "context": [
      "Emissions",
      "Emissions to water",
      "Emissions to water, unspecified"
    ],
    "cas_numbers": [
      "636-21-5"
    ],
    "ec_numbers": [
      "211-252-8"
    ],
    "unit": "kg"
  }
}

2-aminotoluene Hydrochloride

Identity

Context

Alternative labels

Source lists

Concept associations

Characterisation factors

History

Full record

Keyboard