4-Benzenesulfonyl-2-bromo-phenol
Basic information
- Standard SMILES
O=S(=O)(c1ccccc1)c1ccc(O)c(Br)c1- InChIKey
YLPUETQYWFVVMV-UHFFFAOYSA-N- Molecular formula
- C12H9BrO3S
- Average molar mass
- 313.17 g/mol
- Monoisotopic mass
- 311.94558
Names & identifiers
- Preferred name
- 4-Benzenesulfonyl-2-bromo-phenol
- IUPAC
- 4-(benzenesulfonyl)-2-bromophenol
Names & synonyms
SCHEMBL31454654-benzenesulfonyl-2-bromo-phenolYLPUETQYWFVVMV-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 59710892
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 62.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 343
Related reactions
1 records
Compound notes
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