Basic information
- Standard SMILES
CCOC(=O)C(C)(C)c1ccc(C(C)=O)cc1- InChIKey
HIWPBPZDGXCXFH-UHFFFAOYSA-N- Molecular formula
- C14H18O3
- Average molar mass
- 234.29 g/mol
- Monoisotopic mass
- 234.12559443
Names & identifiers
- Preferred name
- 2-(4-Acetyl-phenyl)-2-methyl-propionic acid ethyl ester
- IUPAC
- ethyl 2-(4-acetylphenyl)-2-methylpropanoate
Names & synonyms
SCHEMBL6040918HIWPBPZDGXCXFH-UHFFFAOYSA-N2-(4-acetyl-phenyl)-2-methyl-propionic acid ethyl ester
Database identifiers
- PubChem CID
- 69645905
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 286
Related reactions
2 records
Compound notes
Loading…