Basic information
- Standard SMILES
CCOC(=O)C(C)(C)CCO- InChIKey
WJOKYRVCHGXWDJ-UHFFFAOYSA-N- Molecular formula
- C8H16O3
- Average molar mass
- 160.21 g/mol
Names & identifiers
- Preferred name
- 4-Hydroxy-2,2-dimethylbutyric acid ethyl ester
- IUPAC
- ethyl 4-hydroxy-2,2-dimethylbutanoate
Names & synonyms
SCHEMBL1723361WJOKYRVCHGXWDJ-UHFFFAOYSA-Nethyl 4-hydroxy-2,2-dimethylbutanoateDB-4164464-Hydroxy-2,2-dimethylbutyric acid ethyl ester1160064-78-7
Database identifiers
- PubChem CID
- 59614374
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 129
Related reactions
1 records
Compound notes
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