Consensus flow list

Identity

Type
Chemical salt
CAS
6990-43-8
EC
230-257-6
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for Zinc Bis(o,o-dibutyl Dithiophosphate)

Alternative labels

26

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string MECFLMNXIXDIOF-UHFFFAOYSA-L
InChI2D string chemrof:inchi2d_string InChI=1S/2C8H19O2PS2.Zn/c2*1-3-5-7-9-11(12,13)10-8-6-4-2;/h2*3-8H2,1-2H3,(H,12,13);/q;;+2/p-2
IUPAC name chemrof:IUPAC_name Zinc O,O-di-n-butyl phosphorodithioate
Molecular formula chemrof:molecular_formula C16H36O4P2S4Zn
Molecular mass chemrof:molecular_mass 548.066
Monoisotopic mass chemrof:monoisotopic_mass 546.026309
SMILES string chemrof:smiles_string CCCCOP(=S)([S-])OCCCC.CCCCOP(=S)([S-])OCCCC.[Zn+2]

Known URLs

8

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=24645-45-2 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=6990-43-8 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.027.507 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.042.149 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID0064541 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J266.043A enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/81470 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q81991635 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
d462e3a2-47c4-494d-8c4a-cfa54b5fffae Environmental → Air → Aircraft cruise height EF 3.1 kg 4
eb5bb1ae-65d5-428a-b263-40c7cee7a441 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
dccc80ad-1726-4e23-a01d-277424aa9bc7 Environmental → Air → Indoor EF 3.1 kg 4
82aa2122-2582-43d8-9990-6173d881dca0 Environmental → Air → Long-term EF 3.1 kg 0
1e1c0880-572d-43fa-9755-f1257f26b2ce Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
215af59a-8124-4ed8-a78a-2c6afd8936ea Environmental → Air → Unknown EF 3.1 kg 4
ad80fafd-ee01-43d7-b1ad-c6f057fad210 Environmental → Ground → Agricultural EF 3.1 kg 4
78e5e69f-3b1c-489d-b664-9013b6647153 Environmental → Ground → Non-agricultural EF 3.1 kg 4
f8718f15-6470-4a2f-af13-6413490debc5 Environmental → Ground → Unknown EF 3.1 kg 4
d1f5e680-beca-414f-84b5-77c2dc08d7ed Environmental → Water → Long-term EF 3.1 kg 0
2a350f6f-9ac8-4295-a559-86a26f19a913 Environmental → Water → Ocean EF 3.1 kg 4
79bbf009-c56c-4a63-83d2-c9b452c1290b Environmental → Water → Surface water EF 3.1 kg 4
39a3ed79-2139-41a2-877f-5a53ed7de991 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-edde7c556afa9faf",
  "prefLabel": [
    {
      "@value": "Zinc Bis(o,o-dibutyl Dithiophosphate)",
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  ],
  "altLabel": [
    {
      "@value": "(T-4)-Bis(O,O-dibutyl phosphorodithioato-κS,κS′)zinc",
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        ],
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      }
    },
    {
      "@value": "Butyl zinc phosphorodithioate (Zn[(BuO)2(S)PS]2)",
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      "@lang": "en",
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    },
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      "@value": "Meraphos P",
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    },
    {
      "@value": "Phosphorodithioic acid, O,O-dibutyl ester, zinc complex",
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      "@value": "Phosphorodithioic acid, O,O-dibutyl ester, zinc salt",
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    {
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      "@value": "TP/S",
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    {
      "@value": "Vocol",
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    },
    {
      "@value": "Vocol 5",
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      }
    },
    {
      "@value": "Vocol S",
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    },
    {
      "@value": "Vocol S 75",
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    },
    {
      "@value": "Vocol ZBPD",
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        ],
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      }
    },
    {
      "@value": "ZBPD",
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        ],
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      }
    },
    {
      "@value": "ZBPD 50GE",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Zinc bis(dibutyl dithiophosphate)",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Zinc bis(O,O-dibutylphosphorodithioate)",
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        ],
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      }
    },
    {
      "@value": "Zinc dibutyl dithiophosphate",
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      }
    },
    {
      "@value": "Zinc dibutyl phosphorodithioate",
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      }
    },
    {
      "@value": "Zinc O,O-di-n-butyl phosphorodithioate",
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    },
    {
      "@value": "Zinc O,O-dibutyl dithiophosphate",
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    },
    {
      "@value": "Zinc O,O-dibutyl phosphorodithioate",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Zinc O,O′-dibutylphosphorodithioate",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Zinc, bis(O,O-dibutyl phosphorodithioato-S,S′)-, (T-4)-",
      "@language": "en",
      "@lang": "en",
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    },
    {
      "@value": "Zinc, bis(O,O-dibutyl phosphorodithioato-κS,κS′)-, (T-4)-",
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  ],
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C16H36O4P2S4Zn"
      ],
      "attested_by": {
        "C16H36O4P2S4Zn": [
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          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "Molecular formula",
      "provenance": [
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        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
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          "prov:hadPrimarySource": [
            "CCCCOP(=S)([S-])OCCCC.CCCCOP(=S)([S-])OCCCC.[Zn+2]"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "MECFLMNXIXDIOF-UHFFFAOYSA-L"
      ],
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      "rdfs:label": "InChIKey",
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        {
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          "prov:hadPrimarySource": [
            "CCCCOP(=S)([S-])OCCCC.CCCCOP(=S)([S-])OCCCC.[Zn+2]"
          ]
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      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
        "CCCCOP(=S)([S-])OCCCC.CCCCOP(=S)([S-])OCCCC.[Zn+2]"
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    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/2C8H19O2PS2.Zn/c2*1-3-5-7-9-11(12,13)10-8-6-4-2;/h2*3-8H2,1-2H3,(H,12,13);/q;;+2/p-2"
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      "attested_by": {
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    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "rdfs:label": "IUPAC name",
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      "attested_by": {
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    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "rdfs:label": "Molecular mass",
      "@value": [
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      ],
      "provenance": [
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        },
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