2-Benzylsulfanyl-2-phenyl-acetic acid
Basic information
- CAS
33767-32-7- Standard SMILES
O=C(O)C(SCc1ccccc1)c1ccccc1- InChIKey
CCMOFMGHPPQGJB-UHFFFAOYSA-N- Molecular formula
- C15H14O2S
- Average molar mass
- 258.3 g/mol
- Monoisotopic mass
- 258.07145086
Names & identifiers
- Preferred name
- 2-Benzylsulfanyl-2-phenyl-acetic acid
- IUPAC
- 2-benzylsulfanyl-2-phenylacetic acid
Names & synonyms
33767-32-7NSC1099412-benzylsulfanyl-2-phenyl-acetic acidSCHEMBL28065856AKOS000200153AKOS017268689NSC-109941DS-012995
Database identifiers
- CAS
33767-32-7- PubChem CID
- 269283
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 62.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 255
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…