4-Fluorophenylboronic acid

CAT: 0024-sc-254674ASize: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-254674ASize:5 g

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CAS Number

1765-93-1

Chemical Information

4-Fluorophenylboronic acid

4-fluorophenylboronic acid is an organofluorine compound. It is functionally related to a phenylboronic acid.

CAS Number	1765-93-1
PubChem CID	285645
IUPAC Name	(4-fluorophenyl)boronic acid
Molecular Formula	C6H6BFO2
Molecular Weight	139.92
Topological Polar Surface Area	40.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	10
Formal Charge	0
Complexity	102

SMILES

B(C1=CC=C(C=C1)F)(O)O

InChI

InChI=1S/C6H6BFO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4,9-10H

InChIKey

LBUNNMJLXWQQBY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1765-93-1

CID: 285645

Formula: C6H6BFO2

MW: 139.92

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	139.92
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	140.0444878
Monoisotopic Mass	140.0444878
Topological Polar Surface Area	40.5 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	102
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-290105	4-Carboxy-2-fluorophenylboronic acid
sc-290105A	4-Carboxy-2-fluorophenylboronic acid
sc-261875A	4-Chloro-2-fluorophenylboronic acid
sc-261869A	4-Carboxy-3-fluorophenylboronic acid
sc-289579A	4- (Dimethylcarbamoyl) -2-fluorophenylboronic acid
sc-289579	4- (Dimethylcarbamoyl) -2-fluorophenylboronic acid
sc-289569A	4- (Cyclopentylcarbamoyl) -3-fluorophenylboronic acid
sc-289580	4- (Dimethylcarbamoyl) -3-fluorophenylboronic acid
sc-299493	4-Cyano-2-fluorophenylboronic acid
sc-299493A	4-Cyano-2-fluorophenylboronic acid

Catalog	Name
FF03381-01	4-Fluorophenylboronic acid
PC408438-01	4-Fluorophenylboronic acid anhydride
432494-01	4-Fluorophenylboronic acid, pinacol ester
431335-01	4-Butoxy-3-fluorophenylboronic Acid
429537-01	4- (Ethoxycarbonyl) -2-fluorophenylboronic acid
429523-01	4- (Dimethylcarbamoyl) -3-fluorophenylboronic acid
425227-01	3-Cyano-4-fluorophenylboronic acid
TYD-00537-01	4-Chloro-3-fluorophenylboronic acid
233188-01	4-Fluorophenylboronic acid 98+% (HPLC)
261847-01	4-Bromo-3-fluorophenylboronic acid