Basic information
- Standard SMILES
CCOS(=O)(=O)Cc1ccc(C)cc1- InChIKey
SHKCSNNWEJSWHZ-UHFFFAOYSA-N- Molecular formula
- C10H14O3S
- Average molar mass
- 214.28 g/mol
Names & identifiers
- Preferred name
- Ethyl 4-methylphenylmethanesulfonate
- IUPAC
- ethyl (4-methylphenyl)methanesulfonate
Names & synonyms
SCHEMBL4681715SHKCSNNWEJSWHZ-UHFFFAOYSA-Nethyl 4-methylphenylmethanesulfonate
Database identifiers
- PubChem CID
- 12456502
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 245
Related reactions
4 records
Compound notes
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