Carbonic acid, dithio-, S-benzyl O-(p-(methylthio)phenyl) ester
Basic information
- CAS
24498-25-7- Standard SMILES
CSc1ccc(OC(=S)SCc2ccccc2)cc1- InChIKey
CZBDTIBBVLLISW-UHFFFAOYSA-N- Molecular formula
- C15H14OS3
- Average molar mass
- 306.5 g/mol
- Monoisotopic mass
- 306.02067859
Names & identifiers
- Preferred name
- Carbonic acid, dithio-, S-benzyl O-(p-(methylthio)phenyl) ester
- IUPAC
- O-(4-methylsulfanylphenyl) benzylsulfanylmethanethioate
Names & synonyms
24498-25-7s-benzyl o-[4-(methylsulfanyl)phenyl] carbonodithioateCarbonic acid, dithio-, S-benzyl O-(p-(methylthio)phenyl) esterDTXSID30947393
Database identifiers
- CAS
24498-25-7- PubChem CID
- 190261
- DTXSID
DTXSID30947393
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 91.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 269
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…