Basic information
- Standard SMILES
COC1(B(O)O)C=CC=CC1OCc1ccccc1- InChIKey
NIUSTLWLTGDRNA-UHFFFAOYSA-N- Molecular formula
- C14H17BO4
- Average molar mass
- 260.1 g/mol
- Monoisotopic mass
- 260.1219892
Names & identifiers
- Preferred name
- 2-Benzyloxy-1-methoxybenzeneboronic acid
- IUPAC
- (1-methoxy-6-phenylmethoxycyclohexa-2,4-dien-1-yl)boronic acid
Names & synonyms
SCHEMBL3413502NIUSTLWLTGDRNA-UHFFFAOYSA-N2-Benzyloxy-1-methoxybenzeneboronic acid
Database identifiers
- PubChem CID
- 68633201
Properties
Computed structural properties
- Topological polar surface area
- 58.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 336
Related reactions
2 records
Compound notes
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