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Structure

3-Bromo-2,6-difluorophenylboronic acid

CAS
352535-84-3
Catalog Number
ACM352535843
Category
Boronic Acids
Molecular Weight
236.81g/mol
Molecular Formula
C6H4BBrF2O2

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Specification

IUPAC Name
(3-bromo-2,6-difluorophenyl)boronic acid
Canonical SMILES
B(C1=C(C=CC(=C1F)Br)F)(O)O
InChI
InChI=1S/C6H4BBrF2O2/c8-3-1-2-4(9)5(6(3)10)7(11)12/h1-2,11-12H
InChI Key
IOPHTXLBAFNMMI-UHFFFAOYSA-N
Complexity
161
Covalently-Bonded Unit Count
1
Exact Mass
235.94558g/mol
Formal Charge
0
H-Bond Acceptor
4
H-Bond Donor
2
Heavy Atom Count
12
Monoisotopic Mass
235.94558g/mol
Rotatable Bond Count
1
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