3,5-Difluoro-4-formylphenylboronic acid

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Catalog Number
ACM870718119
Product Name
3,5-Difluoro-4-formylphenylboronic acid
Structure
Structure
CAS
870718-11-9
Category
Heterocyclic Organic Compound
IUPAC Name
(3,5-difluoro-4-formylphenyl)boronic acid
Molecular Weight
185.92g/mol
Molecular Formula
C7H5BF2O3
Canonical SMILES
B(C1=CC(=C(C(=C1)F)C=O)F)(O)O
InChI
InChI=1S/C7H5BF2O3/c9-6-1-4(8(12)13)2-7(10)5(6)3-11/h1-3,12-13H
InChI Key
XWZOKATWICIEMU-UHFFFAOYSA-N
Complexity
179
Covalently-Bonded Unit Count
1
Exact Mass
186.02998g/mol
Formal Charge
0
H-Bond Acceptor
5
H-Bond Donor
2
Heavy Atom Count
13
Monoisotopic Mass
186.02998g/mol
Rotatable Bond Count
2
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