Basic information
- Standard SMILES
COc1cc(C)c(OB(O)O)c(OC)c1- InChIKey
CLUQKNHZIUOTLT-UHFFFAOYSA-N- Molecular formula
- C9H13BO5
- Average molar mass
- 212.01 g/mol
Names & identifiers
- Preferred name
- 2,4-Dimethoxy-6-methylphenylboric acid
- IUPAC
- (2,4-dimethoxy-6-methylphenoxy)boronic acid
Names & synonyms
SCHEMBL1942567CLUQKNHZIUOTLT-UHFFFAOYSA-N2,4-dimethoxy-6-methylphenylboric acid6-methyl-2,4-dimethoxyphenylboric acid
Database identifiers
- PubChem CID
- 21984740
Properties
Computed structural properties
- Topological polar surface area
- 68.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 189
Related reactions
7 records
Compound notes
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