[2-(bromomethyl)-3,4-dimethyl-phenyl]boronic acid

Systemtic Name: [2-(bromomethyl)-3,4-dimethyl-phenyl]boronic acid Openeye Name: [2-(bromomethyl)-3,4-dimethyl-phenyl]boronic acid CAS Name: [2-(bromomethyl)-3,4-dimethylphenyl]boronic acid IUPAC Name: [2-(bromomethyl)-3,4-dimethylphenyl]boronic acid Traditional Name: [2-(bromomethyl)-3,4-dimethyl-phenyl]boronic acid Formula: C9H12BBrO2 MolecularWeight: 242.90538

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=C(C(=C(C=C1)C)C)CBr)(O)O

Isomeric SMILES

B(C1=C(C(=C(C=C1)C)C)CBr)(O)O

InChI

InChI=1S/C9H12BBrO2/c1-6-3-4-9(10(12)13)8(5-11)7(6)2/h3-4,12-13H,5H2,1-2H3