Basic information
- Standard SMILES
COC(=O)CSC(c1ccccc1Cl)c1ccccc1Cl- InChIKey
JTRAEEAYRADKCJ-UHFFFAOYSA-N- Molecular formula
- C16H14Cl2O2S
- Average molar mass
- 341.3 g/mol
Names & identifiers
- Preferred name
- Methyl [[bis-(2-chlorophenyl)methyl]thio]acetate
- IUPAC
- methyl 2-[bis(2-chlorophenyl)methylsulfanyl]acetate
Names & synonyms
JTRAEEAYRADKCJ-UHFFFAOYSA-Nmethyl [[bis-(2-chlorophenyl)methyl]thio]acetate
Database identifiers
- PubChem CID
- 53974093
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 51.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 318
Related reactions
1 records
Compound notes
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