Basic information
- Standard SMILES
COC(=O)C(C)(C)c1ccc(CCOS(C)(=O)=O)cc1- InChIKey
GODUJKMCYWIPOE-UHFFFAOYSA-N- Molecular formula
- C14H20O5S
- Average molar mass
- 300.37 g/mol
Names & identifiers
- Preferred name
- 2-[4-(2-Methanesulfonyloxy-ethyl)-phenyl]-2-methyl-propionic acid methylester
- IUPAC
- methyl 2-methyl-2-[4-(2-methylsulfonyloxyethyl)phenyl]propanoate
Names & synonyms
SCHEMBL3662277GODUJKMCYWIPOE-UHFFFAOYSA-N2-[4-(2-methanesulfonyloxy-ethyl)-phenyl]-2-methyl-propionic acid methylester
Database identifiers
- PubChem CID
- 45257529
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 78.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 413
Related reactions
7 records
Compound notes
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