(2-Hydroxyphenyl)boronic acid

C₆H₇BO₃CAS 89466-08-0137.93 g/mol

Open in Covalent MOL file

Boronic acid Phenol

Properties

Molecular formula: C₆H₇BO₃
Molar mass: 137.93 g/mol
Exact mass: 138.0488 Da
logP: -0.93Crippen estimate
Polar surface area: 60.7 Å²
H-bond donors / acceptors: 3 / 3
Rotatable bonds: 1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

89466-08-0

SMILES

B(C1=CC=CC=C1O)(O)O

InChIKey

YDMRDHQUQIVWBE-UHFFFAOYSA-N

InChI

InChI=1S/C6H7BO3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8-10H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

2-Hydroxyphenylboronic acid

Work with (2-Hydroxyphenyl)boronic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

(2-Bromophenyl)boronic acid244205-40-152 % similar Catechol120-80-950 % similar 2-Methylphenylboronic acid16419-60-650 % similar 2-Fluorophenylboronic acid1993-03-950 % similar 2-Chlorophenylboronic acid3900-89-850 % similar B-(2-Aminophenyl)boronic acid5570-18-350 % similar (5-Chloro-2-hydroxyphenyl)boronic Acid (contains varying amounts of Anhydride)89488-25-548 % similar 1-Naphthylboronic acid13922-41-348 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

(4-Hydroxyphenyl)boronic acid71597-85-8 (3-Hydroxyphenyl)boronic acid87199-18-6

Elsewhere

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