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Basic information
- Standard SMILES
CS(=O)(=O)c1ccc(-n2ccnc2)cc1- InChIKey
FXOACTJIQRKTQD-UHFFFAOYSA-N- Molecular formula
- C10H10N2O2S
- Average molar mass
- 222.27 g/mol
- Monoisotopic mass
- 222.04629874
Names & identifiers
- Preferred name
- 1-[4-(methylsulfonyl)phenyl]-1H-imidazole
- IUPAC
- 1-(4-methylsulfonylphenyl)imidazole
Names & synonyms
SCHEMBL8797691SCHEMBL18230273FXOACTJIQRKTQD-UHFFFAOYSA-N190200-82-91-[4-(methylsulfonyl)phenyl]-1H-imidazoleDB-111154
Database identifiers
- PubChem CID
- 11637151
- Nikkaji
- J2.304.018B
Properties
Computed structural propertiesFilling in
- XLogP
- 0.9
- Topological polar surface area
- 60.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 302
Related reactions
1 records
Compound notes
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