Basic information
- CAS
18722-80-0- Standard SMILES
COP(=S)(OC)SCSc1ccccc1- InChIKey
REKAQZOUNOBYJX-UHFFFAOYSA-N- Molecular formula
- C9H13O2PS3
- Average molar mass
- 280.4 g/mol
- Monoisotopic mass
- 279.98153017
Names & identifiers
- Preferred name
- Phosphorodithioic acid, O,O-dimethyl S-((phenylthio)-methyl) ester
- IUPAC
- dimethoxy-(phenylsulfanylmethylsulfanyl)-sulfanylidene-λ5-phosphane
- English name
- ENT 25,594
- Molecular weight
- 0
Names & synonyms
Geigy G-3049218722-80-0ENT 25,594Phosphorodithioic acid, O,O-dimethyl S-((phenylthio)-methyl) esterBRN 1969518AI3-25594DTXSID30171994RefChem:371176DTXCID6094485o,o-dimethyl s-[(phenylsulfanyl)methyl] phosphorodithioatedimethoxy-(phenylsulfanylmethylsulfanyl)-sulfanylidene-lambda5-phosphaneSCHEMBL11437163
Show more names
Geigy-30492Dithiophosphoric acid O,O-dimethyl S-(phenylthio)methyl esterPhosphorodithioic acid S-[(phenylthio)methyl]O,O-dimethyl ester
Database identifiers
- CAS
18722-80-0- PubChem CID
- 87763
- DTXSID
DTXSID30171994- Nikkaji
- J53.814K
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 211
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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