2,2-Dimethyl-4-benzyloxycarbonylbutyric acid
Basic information
- Standard SMILES
CC(C)(CCC(=O)OCc1ccccc1)C(=O)O- InChIKey
AMPMGEZRUKBYJC-UHFFFAOYSA-N- Molecular formula
- C14H18O4
- Average molar mass
- 250.29 g/mol
Names & identifiers
- Preferred name
- 2,2-Dimethyl-4-benzyloxycarbonylbutyric acid
- IUPAC
- 2,2-dimethyl-5-oxo-5-phenylmethoxypentanoic acid
Names & synonyms
SCHEMBL8655021AMPMGEZRUKBYJC-UHFFFAOYSA-N2,2-dimethyl-4-benzyloxycarbonylbutyric acid
Database identifiers
- PubChem CID
- 19080045
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 290
Related reactions
2 records
Compound notes
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