Basic information
- Standard SMILES
Cc1cc(C)cc(OS(=O)(=O)c2ccccc2)c1- InChIKey
WZPVLLGMZGPAHN-UHFFFAOYSA-N- Molecular formula
- C14H14O3S
- Average molar mass
- 262.33 g/mol
Names & identifiers
- Preferred name
- 3,5-Dimethylphenyl benzenesulfonate
- IUPAC
- (3,5-dimethylphenyl) benzenesulfonate
Names & synonyms
3,5-dimethylphenyl benzenesulfonateSCHEMBL4642756WZPVLLGMZGPAHN-UHFFFAOYSA-N3,5-dimethylphenol-benzenesulfonate(3,5-dimethylphenyl) benzenesulfonateAKOS008679501Z45536464
Database identifiers
- PubChem CID
- 11242472
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 342
Related reactions
6 records
Compound notes
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