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Structure

5-Bromo-2-fluorophenylboronic acid

CAS
112204-57-6
Catalog Number
ACM112204576
Category
Other Products
Molecular Weight
218.82g/mol
Molecular Formula
C6H5BBrFO2

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Specification

IUPAC Name
(5-bromo-2-fluorophenyl)boronic acid
Canonical SMILES
B(C1=C(C=CC(=C1)Br)F)(O)O
InChI
InChI=1S/C6H5BBrFO2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,10-11H
InChI Key
IGBDPRKNAFOOGY-UHFFFAOYSA-N
Complexity
136
Covalently-Bonded Unit Count
1
Exact Mass
217.955g/mol
Formal Charge
0
H-Bond Acceptor
3
H-Bond Donor
2
Heavy Atom Count
11
Monoisotopic Mass
217.955g/mol
Rotatable Bond Count
1

Downstream Synthesis Route 1

  • 112204-57-6
  • 112204-58-7

Reference: [1]Patent: WO2003/99816,2003,A1 .Location in patent: Page 72

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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