Consensus flow list

O,o-diethyl Dithiophosphate

fo-de35db326e90b4b1

Identity

Type
Neutral molecule
CAS
298-06-6
EC
206-055-9
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for O,o-diethyl Dithiophosphate

Alternative labels

10

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string IRDLUHRVLVEUHA-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C4H11O2PS2/c1-3-5-7(8,9)6-4-2/h3-4H2,1-2H3,(H,8,9)
IUPAC name chemrof:IUPAC_name diethoxy-mercapto-sulfanylidenephosphorane, diethoxy-mercapto-thioxo-phosphorane, diethoxy-sulfanyl-sulfanylidene-lambda5-phosphane, diethoxy-sulfanyl-thioxo-lambda5-phosphane
Molecular formula chemrof:molecular_formula C4H11O2PS2
Molecular mass chemrof:molecular_mass 186.238
Monoisotopic mass chemrof:monoisotopic_mass 185.993808, 185.99381
SMILES string chemrof:smiles_string CCOP(=S)(S)OCC

Known URLs

12

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=298-06-6 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:189749 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.005.506 enrich_references.pubchem_identifier_url
ChemSpider https://www.chemspider.com/Chemical-Structure.8917.html enrich_references.chebi_xrefs
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID6027133 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=171184 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1886492 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/02C5XR639P enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0061736 enrich_references.chebi_xrefs
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.033H enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/9274 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q309536 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
041ff93a-6556-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
08a91e70-3ddc-11dd-970d-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
d73e8e8f-a0e3-4b6a-94b5-aba1d7d7fff9 Environmental → Air → Indoor EF 3.1 kg 2
08a91e70-3ddc-11dd-970c-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
08a91e70-3ddc-11dd-970e-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
08a91e70-3ddc-11dd-9715-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 2
08a91e70-3ddc-11dd-9713-0050c2490048 Environmental → Ground → Agricultural EF 3.1 kg 2
08a91e70-3ddc-11dd-9717-0050c2490048 Environmental → Ground → Non-agricultural EF 3.1 kg 2
08a91e70-3ddc-11dd-9714-0050c2490048 Environmental → Ground → Unknown EF 3.1 kg 2
08a91e70-3ddc-11dd-9710-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 0
08a91e70-3ddc-11dd-9718-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 2
08a91e70-3ddc-11dd-970f-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 2
08a91e70-3ddc-11dd-9716-0050c2490048 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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