5-Fluoro-2-methylphenylboronic Acid

Product Information

Molecular Formula:
C7H8FO2B
Molecular Weight:
153.95
Description
Reactant for: Monoarylation of dibromoarenes catalyzed by palladium-phosphine in the presence of potassium carbonate; Preparation of homoleptic diarylmercurials; Suzuki-Miyaura coupling.
Synonyms
(5-fluoro-2-methylphenyl)boronic acid; (5-fluoro-2-methylphenyl)boronic acid
IUPAC Name
(5-fluoro-2-methylphenyl)boronic acid
Canonical SMILES
B(C1=C(C=CC(=C1)F)C)(O)O
InChI
InChI=1S/C7H8BFO2/c1-5-2-3-6(9)4-7(5)8(10)11/h2-4,10-11H,1H3
InChI Key
QKOJLMKWBRBZNQ-UHFFFAOYSA-N
Boiling Point
287.7 °C at 760 mmHg
Melting Point
144-148 °C (lit.)
Density
1.2 g/cm3
LogP
-0.18610

Safety Information

Precautionary Statement
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning

Computed Properties

Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
1
Exact Mass
154.0601378 g/mol
Monoisotopic Mass
154.0601378 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
11
Formal Charge
0
Complexity
132
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
WO-2022047230-A1 Compounds, compositions and methods for histone lysine demethylase inhibition 2020-08-28
WO-2021216951-A1 Condensed substituted hydropyrroles as antagonists of the muscarinic acetylcholine receptor m4 2020-04-24
WO-2021119254-A1 Antagonists of the muscarinic acetylcholine receptor m4 2019-12-10
CN-112574224-A KRAS G12C inhibitor and application thereof 2019-09-30
WO-2021063346-A1 Kras g12c inhibitor and application thereof 2019-09-30
WO-2020161623-A1 N-(pyridin-2-yl)pyridine-sulfonamide derivatives and their use in the treatment of disease 2019-02-06
CN-113423702-A N- (pyridin-2-yl) pyridine-sulfonamide derivatives and their use in the treatment of disease 2019-02-06
EP-3921313-A1 N-(pyridin-2-yl)pyridine-sulfonamide derivatives and their use in the treatment of disease 2019-02-06
CN-110698507-A Preparation method of aryl vinyl silane compound 2019-01-10
KR-20210040953-A Near-infrared glucose sensor 2018-06-27
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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