6-Trifluoromethyl-2-pyridyl-boronic acid MIDA ester

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Catalog Number

ACMA00015011

Product Name

6-Trifluoromethyl-2-pyridyl-boronic acid MIDA ester

Category

Salt

IUPAC Name

5-methyl-1-[6-(trifluoromethyl)pyridin-2-yl]-2,8-dioxa-5-azonia-1-boranuidabicyclo[3.3.0]octane-3,7-dione

Molecular Weight

302.02g/mol

Molecular Formula

C11H10BF3N2O4

Canonical SMILES

[B-]12([N+](CC(=O)O1)(CC(=O)O2)C)C3=NC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C11H10BF3N2O4/c1-17-5-9(18)20-12(17,21-10(19)6-17)8-4-2-3-7(16-8)11(13,14)15/h2-4H,5-6H2,1H3

InChI Key

ZWEWMCPRZJIIQY-UHFFFAOYSA-N

Complexity

478

Covalently-Bonded Unit Count

Exact Mass

302.068572g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

302.068572g/mol

Rotatable Bond Count

MSDS

COA

Spec Sheet

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