Basic information
- CAS
7452-38-2- Standard SMILES
CCOP(=S)(Oc1ccc(SC)cc1)c1ccccc1- InChIKey
MGGSBJJMHABXAD-UHFFFAOYSA-N- Molecular formula
- C15H17O2PS2
- Average molar mass
- 324.4 g/mol
- Monoisotopic mass
- 324.04075913
Names & identifiers
- Preferred name
- Phosphonothioic acid, phenyl-, O-ethyl O-(p-(methylthio)phenyl) ester
- IUPAC
- ethoxy-(4-methylsulfanylphenoxy)-phenyl-sulfanylidene-λ5-phosphane
Names & synonyms
BRN 2290422O-Ethyl O-(p-(methylthio)phenyl) phenylphosphonothioate7452-38-2Phosphonothioic acid, phenyl-, O-ethyl O-(p-(methylthio)phenyl) esterRefChem:370747DTXSID70996042O-Ethyl O-[4-(methylsulfanyl)phenyl] phenylphosphonothioate
Database identifiers
- CAS
7452-38-2- PubChem CID
- 197872
- DTXSID
DTXSID70996042
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 75.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 324
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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