Consensus flow list

Identity

Substance
fo-54df4b2e42857ffb Neutral molecule
Source
EF 3.1
Unit
kg
Context
Environmental → Ground → Non-agricultural
CAS
31027-31-3
EC
250-439-9

Context

Dimension
Environmental
Geography
Non-agricultural
Media
Ground

Alternative labels

9

Source lists

1
List Version Source flow Name there Why this flow
EF 3.1 1a804ff3-0c93-40f5-acbf-352f5a3e2ecb p-isopropylphenyl isocyanate 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 1a804ff3-0c93-40f5-acbf-352f5a3e2ecb p-isopropylphenyl isocyanate Emissions/Emissions to soil/Emissions to non-agricultural soil exactMatch

Characterisation factors

4

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 62.691
EF 3.1 consensus-flow-list Ecotoxicity, freshwater 62.691 sole
EF 3.1 European Commission — JRC Ecotoxicity, freshwater_organics 62.691
EF 3.1 consensus-flow-list Ecotoxicity, freshwater_organics 62.691 sole

This flow in the difference report

History

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.

Full record

Flow JSON
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      "@value": "1-Isocyanato-4-(propan-2-yl)benzene",
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    },
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      "@value": "4-(1-Methylethyl)phenylisocyanate",
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    },
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    },
    {
      "@value": "p-Cumenyl isocyanate",
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    },
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    },
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      },
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    "media": "Ground",
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    }
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    "types": "link_flows_to_their_substance"
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  "cas_match_labels": {
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  "_transformed": true,
  "_provided": {
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    "synonyms": [
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    "context": [
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    ],
    "ec_numbers": [
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    "unit": "kg"
  }
}

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