Basic information
- Standard SMILES
CC(C)(Cc1ccccc1B(O)O)C(=O)O- InChIKey
VBFLOWDKHVNYOI-UHFFFAOYSA-N- Molecular formula
- C11H15BO4
- Average molar mass
- 222.05 g/mol
Names & identifiers
- Preferred name
- (2-Carboxy-2-methylpropyl)benzeneboronic acid
- IUPAC
- 3-(2-boronophenyl)-2,2-dimethylpropanoic acid
Names & synonyms
SCHEMBL7362946VBFLOWDKHVNYOI-UHFFFAOYSA-N(2-carboxy-2-methylpropyl)benzeneboronic acid
Database identifiers
- PubChem CID
- 21186352
Properties
Computed structural properties
- Topological polar surface area
- 77.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 252
Related reactions
1 records
Compound notes
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