Consensus flow list

Identity

Substance
fo-a2155d4478ab7217 ChemicalSalt
Source
EF 3.1
Unit
kg
Context
Environmental → Ground → Non-agricultural
CAS
28629-66-5
EC
249-109-7

Context

Dimension
Environmental
Geography
Non-agricultural
Media
Ground

Alternative labels

8

Source lists

1
List Version Source flow Name there Why this flow
EF 3.1 9df01cca-02e8-4eb0-9632-9d4749bab5e2 zinc bis(O,O-diisooctyl) bis(dithiophosphate) 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 9df01cca-02e8-4eb0-9632-9d4749bab5e2 zinc bis(O,O-diisooctyl) bis(dithiophosphate) Emissions/Emissions to soil/Emissions to non-agricultural soil exactMatch

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
{
  "altLabel": [
    {
      "@value": "Bis(O,O-diisooctyl phosphorodithioato-κS,κS′)zinc",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Phosphorodithioic acid, O,O-diisooctyl ester, zinc complex",
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      }
    },
    {
      "@value": "Phosphorodithioic acid, O,O-diisooctyl ester, zinc salt",
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      }
    },
    {
      "@value": "Zinc bis(O,O-diisooctylphosphorodithioate-S,S′)",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Zinc bis(diisooctyl dithiophosphate)",
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      }
    },
    {
      "@value": "Zinc diisooctyl dithiophosphate",
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    },
    {
      "@value": "Zinc, bis(O,O-diisooctyl phosphorodithioato-S,S′)-",
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  ],
  "properties": {
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      "@value": [
        "C32H68O4P2S4Zn"
      ],
      "attested_by": {
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      },
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      ]
    },
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        "zinc bis(bis(6-methylheptoxy)-sulfanylidene-sulfido-lambda5-phosphane)",
        "zinc bis(bis(6-methylheptoxy)-sulfanylidene-sulfidophosphorane)",
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