2-(trifluoromethyl)pyridine-4-boronic acid - Materials / Alfa Chemistry

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2-(trifluoromethyl)pyridine-4-boronic acid

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Catalog Number

ACMA00015322

Product Name

2-(trifluoromethyl)pyridine-4-boronic acid

Category

Salt

IUPAC Name

[2-(trifluoromethyl)pyridin-4-yl]boronic acid

Molecular Weight

190.92g/mol

Molecular Formula

C6H5BF3NO2

Canonical SMILES

B(C1=CC(=NC=C1)C(F)(F)F)(O)O

InChI

InChI=1S/C6H5BF3NO2/c8-6(9,10)5-3-4(7(12)13)1-2-11-5/h1-3,12-13H

InChI Key

PHLLTVDZCKUNJN-UHFFFAOYSA-N

Complexity

176

Covalently-Bonded Unit Count

Exact Mass

191.036543g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

191.036543g/mol

Rotatable Bond Count

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