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2,3,6-Trifluorophenylboronic acid

Catalog NumberACM247564712

CAS Number247564-71-2

CategorySalt

2,3,6-Trifluorophenylboronic acid
Synonyms
RARECHEM AH PB 0123;RARECHEM AH PB 0119;2,3,6-Trifluorobenzeneboronic acid;2,3,6-Trifluorophenylboronic acid;2,3,6-Trifluorophenylboronic acid
IUPAC Name
(2,3,6-trifluorophenyl)boronic acid
Molecular Weight
175.9g/mol
Molecular Formula
C6H4BF3O2
Canonical SMILES
B(C1=C(C=CC(=C1F)F)F)(O)O
InChI
InChI=1S/C6H4BF3O2/c8-3-1-2-4(9)6(10)5(3)7(11)12/h1-2,11-12H
InChI Key
IWPDDRPLEKURGG-UHFFFAOYSA-N
Complexity
158
Covalently-Bonded Unit Count
1
Exact Mass
176.025644g/mol
Formal Charge
0
Heavy Atom Count
12
Monoisotopic Mass
176.025644g/mol
Rotatable Bond Count
1
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