Basic information
- CAS
2984-68-1- Standard SMILES
COP(C)(=S)Sc1ccccc1- InChIKey
PVYWTIYKBRDJCB-UHFFFAOYSA-N- Molecular formula
- C8H11OPS2
- Average molar mass
- 218.3 g/mol
- Monoisotopic mass
- 217.99889431
Names & identifiers
- Preferred name
- O-Methyl S-phenyl methylphosphonodithioate
- IUPAC
- methoxy-methyl-phenylsulfanyl-sulfanylidene-λ5-phosphane
- English name
- Methyldithiophosphonic acid O-methyl S-phenyl ester
- Molecular formula
- C8H11OPS2
- Molecular weight
- 218.28
Names & synonyms
O-Methyl S-phenyl methylphosphonodithioate2984-68-1DTXSID80952295RefChem:1093698DTXCID101380393Stauffer N-3727ENT 25,961BRN 2093719AI3-25961N 3727Phosphonodithioic acid, methyl-, O-methyl S-phenyl esterN-3727
Show more names
ENT-25961Methyldithiophosphonic acid O-methyl S-phenyl esterPhosphonodithioic acid, methyl-, O-methyl S-phenyl ester (7CI,8CI,9CI)
Database identifiers
- CAS
2984-68-1- PubChem CID
- 76329
- DTXSID
DTXSID80952295- Nikkaji
- J7.401B
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 66.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 178
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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