B-(3-Fluoro-2-formylphenyl)boronic acid

C7H6BFO3CAS 871126-15-7167.93 g/mol

OFBOHHO
AldehydeAryl halideBoronic acid

Properties

Molecular formula
C7H6BFO3
Molar mass
167.93 g/mol
Exact mass
168.0394 Da
logP
-0.68Crippen estimate
Polar surface area
57.5 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
2

Hazards

Danger
Corrosive (GHS05)

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, P501

Identifiers

CAS number
871126-15-7
SMILES
O=Cc1c(F)cccc1B(O)O
InChIKey
GVHWLCYABLWGIR-UHFFFAOYSA-N
InChI
InChI=1S/C7H6BFO3/c9-7-3-1-2-6(8(11)12)5(7)4-10/h1-4,11-12H

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Names and synonyms

4 names
  • Boronic acid, B-(3-fluoro-2-formylphenyl)-
  • Boronic acid, (3-fluoro-2-formylphenyl)-
  • (3-Fluoro-2-formylphenyl)boronic acid
  • 3-Fluoro-2-formylbenzeneboronic acid

Work with B-(3-Fluoro-2-formylphenyl)boronic acid

Similar compounds

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

Same formula

Elsewhere