Basic information
- Standard SMILES
CS(=O)(=O)c1ccc(-c2ccc(O)cc2)cn1- InChIKey
NISPECYFPUELQI-UHFFFAOYSA-N- Molecular formula
- C12H11NO3S
- Average molar mass
- 249.29 g/mol
Names & identifiers
- Preferred name
- 4-(6-(Methylsulfonyl)pyridin-3-yl)phenol
- IUPAC
- 4-(6-methylsulfonyl-3-pyridinyl)phenol
Names & synonyms
4-(6-(methylsulfonyl)pyridin-3-yl)phenolSCHEMBL386539NISPECYFPUELQI-UHFFFAOYSA-N4-(6-Methanesulfonylpyridin-3-yl)phenol4-[6-(methylsulfonyl)-3-pyridinyl]phenol
Database identifiers
- PubChem CID
- 57457980
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 341
Related reactions
4 records
Compound notes
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