Organofluorine / Alfa Chemistry
4-Fluorobenzeneboronic acid

4-Fluorobenzeneboronic acid

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4-Fluorobenzeneboronic acid
Catalog OFC1765931
CAS 1765-93-1
Category Fluorinated Organic Electronics Materials
Synonyms (4-fluorophenyl) boronic acid; (4-fluorophenyl)boranediol
Purity 98%
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Other Identifiers Chemical Data Computational Chemistry
IUPAC Name (4-fluorophenyl)boronic acid
InChI InChI=1S/C6H6BFO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4,9-10H
InChI Key LBUNNMJLXWQQBY-UHFFFAOYSA-N
Isomeric SMILES B(C1=CC=C(C=C1)F)(O)O
Molecular Formula C6H6BFO2
Molecular Weight 139.92
Melting Point 263-265 °C
Boiling Point 258.4 °C (760 mmHg)
Refractive Index 1.528
Appearance White or nearly white powder
Storage 0-6 °C
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 140.0444878 g/mol
Monoisotopic Mass 140.0444878 g/mol
Topological Polar Surface Area 40.5Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 102

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