Basic information
- Standard SMILES
CCOP(=S)(OCC)SCSC(C)(C)c1ccc(Cl)cc1- InChIKey
CQIVZNFWASHXFS-UHFFFAOYSA-N- Molecular formula
- C14H22ClO2PS3
- Average molar mass
- 385 g/mol
Names & identifiers
- Preferred name
- S-(p-Chloro-alpha,alpha-Dimethylbenzylthio)methyl O,O-Diethyl Phosphorodithioate
- IUPAC
- 2-(4-chlorophenyl)propan-2-ylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-λ5-phosphane
Names & synonyms
SCHEMBL11795988CQIVZNFWASHXFS-UHFFFAOYSA-NS-(p-Chloro-alpha,alpha-Dimethylbenzylthio)methyl O,O-Diethyl Phosphorodithioate
Database identifiers
- PubChem CID
- 21489024
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 337
Related reactions
1 records
Compound notes
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