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Zinc O,o,o',o'-tetrakis(1,3-dimethylbutyl) Bis(phosphorodithioate)

fo-8637f46d3cbf531c

Identity

Type
Chemical salt
CAS
2215-35-2
EC
218-679-9
Origin
EF 3.1 hybrid_name_cas_v1
Changes
59 across every transformer

Structure

Structure diagram for Zinc O,o,o',o'-tetrakis(1,3-dimethylbutyl) Bis(phosphorodithioate)

Alternative labels

11

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string SVGYUUVJEMDZDP-UHFFFAOYSA-L
InChI2D string chemrof:inchi2d_string InChI=1S/2C12H27O2PS2.Zn/c2*1-9(2)7-11(5)13-15(16,17)14-12(6)8-10(3)4;/h2*9-12H,7-8H2,1-6H3,(H,16,17);/q;;+2/p-2
IUPAC name chemrof:IUPAC_name zinc bis(bis(1,3-dimethylbutoxy)-sulfido-thioxo-lambda5-phosphane), zinc bis(bis(1,3-dimethylbutoxy)-sulfido-thioxo-phosphorane), zinc bis(bis(4-methylpentan-2-yloxy)-sulfanidyl-sulfanylidene-lambda5-phosphane), zinc bis(bis(4-methylpentan-2-yloxy)-sulfanylidene-sulfido-lambda5-phosphane), zinc bis(bis(4-methylpentan-2-yloxy)-sulfanylidene-sulfidophosphorane)
Molecular formula chemrof:molecular_formula C24H52O4P2S4Zn
Molecular mass chemrof:molecular_mass 660.282
Monoisotopic mass chemrof:monoisotopic_mass 658.15151
SMILES string chemrof:smiles_string CC(C)CC(C)OP(=S)(OC(C)CC(C)C)[S-].CC(C)CC(C)OP(=S)(OC(C)CC(C)C)[S-].[Zn+2]

Known URLs

6

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=2215-35-2 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.016.982 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID2027460 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/5ZMG6Q6P0X enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/92171 enrich_references.pubchem_compound
Wikidata https://www.wikidata.org/wiki/Q27263111 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
4485ae7f-673c-4862-9d67-ebe85c90b808 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
7152cc03-4ac9-4b20-b612-b98a3d132c91 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
e0890e19-4e74-4fbd-ae69-dd5b7223739c Environmental → Air → Indoor EF 3.1 kg 4
ab644562-b501-457f-81db-50da042984c9 Environmental → Air → Long-term EF 3.1 kg 0
a06cdc0a-5b55-444d-8de8-e793487195b0 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
bf1b4a47-6208-489d-8171-6b1ecc169a81 Environmental → Air → Unknown EF 3.1 kg 4
8c55849d-74e6-4f36-86b3-bf9220713fb1 Environmental → Ground → Agricultural EF 3.1 kg 4
d795ce46-f6c0-4ee2-9520-be3a3e4db0d1 Environmental → Ground → Non-agricultural EF 3.1 kg 4
717be5a4-7a1c-41df-9083-2be414d022f6 Environmental → Ground → Unknown EF 3.1 kg 4
7e382b10-7c7b-4fdd-984c-373441fd17ed Environmental → Water → Long-term EF 3.1 kg 0
8ad23a19-618c-450f-a042-51ed2d2f43bb Environmental → Water → Ocean EF 3.1 kg 4
ca895296-1daa-405b-bb7a-fc15726ae0cc Environmental → Water → Surface water EF 3.1 kg 4
c9bbb444-5e9b-4eb1-b82b-341942f51b3b Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (59 changes)

Open the changes page

Full record

Flow object JSON 
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        "prov:wasDerivedFrom": "semantic_typing.rule.multi_component_ionic"
      }
    }
  },
  "classifications": {
    "http://semanticscience.org/resource/CHEMINF_000446": {
      "@value": [
        "2215-35-2"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=2215-35-2"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=2215-35-2"
        }
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "218-679-9"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=218-679-9"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "ec_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/ChemicalSalt"
  ]
}

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You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works

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