Consensus flow list

Methyl (2e)-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)prop-2-enoate

d1a29ac4-315a-457c-87a7-541ed2149d2c

Identity

Substance
fo-d570e9d73d7f12a7 NeutralMolecule
Source
EF 3.1
Unit
kg
Context
Environmental → Ground → Unknown
CAS
1333488-95-1
EC
700-526-7

Context

Dimension
Environmental
Geography
Unknown
Media
Ground

Alternative labels

2

Source lists

1
List Version Source flow Name there Why this flow
EF 3.1 d1a29ac4-315a-457c-87a7-541ed2149d2c methyl (2e)-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)prop-2-enoate The consensus list is built from this one, so this row is the flow itself rather than something matched to it.

Concept associations

1
Source list Source flow Name there Compartment there Match Conversion
EF 3.1 d1a29ac4-315a-457c-87a7-541ed2149d2c methyl (2e)-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)prop-2-enoate Emissions/Emissions to soil/Emissions to soil, unspecified exactMatch —

History

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

Open the changes page

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Full record

Flow JSON 
{
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    {
      "@value": "2-Propenoic acid, 2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)-, methyl ester",
      "@language": "en",
      "source": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:1333488-95-1",
          "https://commonchemistry.cas.org/detail?cas_rn=1333488-95-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Methyl 2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)-2-propenoate",
      "@language": "en",
      "source": {
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        "prov:hadPrimarySource": [
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          "https://commonchemistry.cas.org/detail?cas_rn=1333488-95-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "properties": {
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      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "CDKRRBYJCYFHFJ-UHFFFAOYSA-N"
      ],
      "attested_by": {
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          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "InChIKey",
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          "prov:wasDerivedFrom": "commonchemistry.inchiKey"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
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          "prov:hadPrimarySource": [
            "COC(=O)C(C#N)=Cc1cccc2c1OC(F)(F)O2"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_string": {
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      "rdfs:label": "InChI",
      "@value": [
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      ],
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        },
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      ],
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        },
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    },
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        },
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      ],
      "attested_by": {
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    },
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      ],
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          ]
        },
        {
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          "prov:hadPrimarySource": [
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          ]
        }
      ],
      "attested_by": {
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        ]
      },
      "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": [
        267.034314
      ],
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        },
        {
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          ]
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      ],
      "attested_by": {
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        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "rdfs:label": "IUPAC name",
      "@value": [
        "2-Propenoic acid, 2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)-, methyl ester"
      ],
      "provenance": {
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        "prov:hadPrimarySource": [
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        ]
      },
      "attested_by": {
        "2-Propenoic acid, 2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)-, methyl ester": [
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        ]
      }
    }
  },
  "references": [
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        "prov:wasDerivedFrom": "cas_numbers"
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  ],
  "prefLabel": [
    {
      "@value": "Methyl (2e)-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)prop-2-enoate",
      "@language": "en",
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        "prov:hadPrimarySource": [
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  "http://www.w3.org/2004/02/skos/core#definition": [],
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  "identifier": "d1a29ac4-315a-457c-87a7-541ed2149d2c",
  "source": "EF 3.1",
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  ],
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  ],
  "context": {
    "dimension": "Environmental",
    "media": "Ground",
    "geography": "Unknown"
  },
  "synonyms": [],
  "lcia_methods": [
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      "method_uuid": "05316e7a-b254-4bea-9cf0-6bf33eb5c630",
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      "methodology": "Environmental Footprint",
      "impact_category": "Aquatic eco-toxicity",
      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
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    },
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      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
      "characterization_factor": 10441.0
    }
  ],
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  "unit_iri": "https://vocab.brightway.one/units/unit/KiloGM",
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  "concept_associations": [
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        "qudt:hasUnit": {
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        },
        "skos:exactMatch": {
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  ],
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    "synonyms": "bootstrap_labels",
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    "context_iri": "default_context_mapping",
    "unit_iri": "unit_normalization",
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    "altLabel": "consensus_match",
    "cas_match_labels": "consensus_match",
    "concept_associations": "carry_associations_onto_flows",
    "types": "link_flows_to_their_substance"
  },
  "cas_match_labels": {
    "1333488-95-1": "exactMatch"
  },
  "_transformed": true,
  "_provided": {
    "name": "methyl (2e)-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)prop-2-enoate",
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    ],
    "ec_numbers": [
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    ],
    "unit": "kg"
  }
}

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