Basic information
- Standard SMILES
CC(C)(C)C(C#N)C(=O)[O-]- InChIKey
ZRDVHVJLNSJTOE-UHFFFAOYSA-M- Molecular formula
- C7H10NO2-
- Average molar mass
- 140.16 g/mol
Names & identifiers
- Preferred name
- 2-Cyano-3,3-dimethylbutanoate
- IUPAC
- 2-cyano-3,3-dimethylbutanoate
Names & synonyms
AKOS024437504
Database identifiers
- PubChem CID
- 21936714
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 63.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- -1
- Complexity
- 176
Related reactions
1 records
Compound notes
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