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Structure

2-Fluoro-4-formylphenylboronic acid

CAS
871126-22-6
Catalog Number
ACM871126226
Category
Other Products
Molecular Weight
167.93g/mol
Molecular Formula
C7H6BFO3

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Specification

IUPAC Name
(2-fluoro-4-formylphenyl)boronic acid
Canonical SMILES
B(C1=C(C=C(C=C1)C=O)F)(O)O
InChI
InChI=1S/C7H6BFO3/c9-7-3-5(4-10)1-2-6(7)8(11)12/h1-4,11-12H
InChI Key
OAEJODVYVOAOPH-UHFFFAOYSA-N
Complexity
165
Covalently-Bonded Unit Count
1
Exact Mass
168.039402g/mol
Formal Charge
0
H-Bond Acceptor
4
H-Bond Donor
2
Heavy Atom Count
12
Monoisotopic Mass
168.039402g/mol
Rotatable Bond Count
2
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