Basic information
- Standard SMILES
CCOC(=O)c1ccc(OC[C@@H](C)CC)cc1- InChIKey
CPFHGTIJTVYKLC-NSHDSACASA-N- Molecular formula
- C14H20O3
- Average molar mass
- 236.31 g/mol
- Monoisotopic mass
- 236.1412445
Names & identifiers
- Preferred name
- (S)-(+)-Ethyl 4-(2-methylbutyloxy)benzoate
- IUPAC
- ethyl 4-[(2S)-2-methylbutoxy]benzoate
Names & synonyms
CPFHGTIJTVYKLC-NSHDSACASA-N(S)-(+)-Ethyl 4-(2-methylbutyloxy)benzoate
Database identifiers
- PubChem CID
- 53733015
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 220
Related reactions
4 records
Compound notes
Loading…