Consensus flow list

Oxydisulfoton

fo-ad29b04d2a61f6cf

Identity

Type
Neutral molecule
CAS
2497-07-6
EC
219-679-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Oxydisulfoton

Alternative labels

5

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string UPUGLJYNCXXUQV-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C8H19O3PS3/c1-4-10-12(13,11-5-2)14-7-8-15(9)6-3/h4-8H2,1-3H3
IUPAC name chemrof:IUPAC_name O,O-Diethyl S-(2-ethylthionylethyl) phosphorodithioate
Molecular formula chemrof:molecular_formula C8H19O3PS3
Molecular mass chemrof:molecular_mass 290.412
Monoisotopic mass chemrof:monoisotopic_mass 290.02339, 290.023394
SMILES string chemrof:smiles_string CCOP(=S)(OCC)SCCS(=O)CC

Known URLs

13

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=2497-07-6 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:82143 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.017.891 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID4037536 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/573PQK81XK enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J7.595G enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C19009 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C19009 enrich_references.pubchem_identifier_url
ppdb ppdb:2562 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/17242 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#3018 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q7115921 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Oxydisulfoton enrich_references.pubchem_identifier_url

Elementary flows

14
Flow Context Source Unit CFs
42525441-f125-4ddf-8180-97cbc78f0b0f Environmental → Air → Aircraft cruise height EF 3.1 kg 2
3653965f-8700-4b6c-a7a2-03ef3c8ab2cf Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
3b741db6-009d-41ab-8b06-9c78dfb7d1a9 Environmental → Air → Indoor EF 3.1 kg 2
70a83cfa-18a8-4af9-9d8b-45a6591004b5 Environmental → Air → Long-term EF 3.1 kg 0
d28638b2-9e4c-4a1b-9c11-f9ef231cacc7 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
b33d117e-8036-4545-b232-0bf2ce388a92 Environmental → Air → Unknown EF 3.1 kg 2
88cd1062-7e32-47c6-bb7b-71baddc605b5 Environmental → Ground → Agricultural EF 3.1 kg 2
8b3a8756-4af5-4fe4-b0ab-c48b2491a878 Environmental → Ground → Non-agricultural EF 3.1 kg 2
dbd53e815da0d496dc377e5e8908c60944809fd7 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
a91a3c97-2577-42ff-ab7f-9fcde6baaec9 Environmental → Ground → Unknown EF 3.1 kg 2
b49f388e-115e-40f8-a696-a4255d37afd9 Environmental → Water → Long-term EF 3.1 kg 0
6fcd8ed2-65b6-47ca-9a69-2c1dae5d8897 Environmental → Water → Ocean EF 3.1 kg 2
b576b3b2-bfa8-413d-a36c-e069265b6efe Environmental → Water → Surface water EF 3.1 kg 2
ca7f10f9-1b5e-49ff-b40b-e889c5b31324 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON 
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          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "219-679-1"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=219-679-1"
      ],
      "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/NeutralMolecule"
  ]
}

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