Phosphorodithioic acid, S-[(5-chloro-2-thienyl)methyl] O,O-dimethyl ester
Basic information
- CAS
3710-57-4- Standard SMILES
COP(=S)(OC)SCc1ccc(Cl)s1- InChIKey
QGOFCMVZBMHGHR-UHFFFAOYSA-N- Molecular formula
- C7H10ClO2PS3
- Average molar mass
- 288.8 g/mol
- Monoisotopic mass
- 287.9269078
Names & identifiers
- Preferred name
- Phosphorodithioic acid, S-[(5-chloro-2-thienyl)methyl] O,O-dimethyl ester
- IUPAC
- (5-chlorothiophen-2-yl)methylsulfanyl-dimethoxy-sulfanylidene-λ5-phosphane
Names & synonyms
3710-57-4Phosphorodithioic acid, S-[(5-chloro-2-thienyl)methyl] O,O-dimethyl esterS-(5-Chloro-2-thenyl) O,O-dimethyl phosphorodithioatePhosphorodithioic acid, S-((5-chloro-2-thienyl)methyl) O,O-dimethyl esterDTXSID9073331Phosphorodithioic acid, S-(5-chloro-2-thenyl) O,O-dimethyl esterS-[(5-Chlorothiophen-2-yl)methyl] O,O-dimethyl phosphorodithioate
Database identifiers
- CAS
3710-57-4- PubChem CID
- 165149
- DTXSID
DTXSID9073331
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 221
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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