3-fluoro-5-hydroxybenzeneboronic acid

Product Information

Molecular Formula:
C6H6BFO3
Molecular Weight:
155.92
Description
3-fluoro-5-hydroxybenzeneboronic acid can serve as a catalyst for the synthesis of multiple drugs to advance cancer, diabetes, and inflammation research.
Synonyms
(3-fluoro-5-hydroxyphenyl)boronic acid; 3-FLUORO-5-HYDROXYBENZENEBORONIC ACID; (3-FLUORO-5-HYDROXY-PHENYL)BORONIC ACID; (3-fluoro-5-hydroxyphenyl)boronicacid; (3-fluoro-5-hydroxyphenyl)-boronic acid; SY007752; 3-FLUORO-5-HYDROXYPHENYLBORONICACID
IUPAC Name
(3-fluoro-5-hydroxyphenyl)boronic acid
Canonical SMILES
B(C1=CC(=CC(=C1)F)O)(O)O
InChI
InChI=1S/C6H6BFO3/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3,9-11H
InChI Key
RMBFBZIEXCTPDB-UHFFFAOYSA-N
Flash Point
Not applicable

Computed Properties

Hydrogen Bond Donor Count
3
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
1
Exact Mass
156.0394024 g/mol
Monoisotopic Mass
156.0394024 g/mol
Topological Polar Surface Area
60.7Ų
Heavy Atom Count
11
Formal Charge
0
Complexity
133
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

Patents

Publication Number Title Priority Date
CN-113058646-A Heterogeneous hindered Lewis acid-base pair catalyst and preparation method and application thereof 2021-03-26
CN-112574224-A KRAS G12C inhibitor and application thereof 2019-09-30
WO-2021063346-A1 Kras g12c inhibitor and application thereof 2019-09-30
US-2021077385-A1 Wet-packed soft hydrogel ocular inserts 2019-09-18
WO-2021053586-A1 Wet-packed soft hydrogel ocular inserts 2019-09-18
TW-202114636-A Wet-packed soft hydrogel ocular inserts 2019-09-18
WO-2020123395-A1 2-oxoquinazoline derivatives as methionine adenosyltransferase 2a inhibitors 2018-12-10
TW-202039487-A 2-oxoquinazoline derivatives as methionine adenosyltransferase 2a inhibitors 2018-12-10
AU-2019395338-A1 2-oxoquinazoline derivatives as methionine adenosyltransferase 2A inhibitors 2018-12-10
BR-112021010842-A2 2-Oxoquinazoline Derivatives as Methionine Adenosyltransferase 2a Inhibitors 2018-12-10
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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