4-Fluoro-3-hydroxyphenylboronic Acid - CAS 913835-74-2

Catalog:	BB040144
Product Name:	4-Fluoro-3-hydroxyphenylboronic Acid
CAS:	913835-74-2
Synonyms:	(4-fluoro-3-hydroxyphenyl)boronic acid; (4-fluoro-3-hydroxyphenyl)boronic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	(4-fluoro-3-hydroxyphenyl)boronic acid
Description:	4-Fluoro-3-hydroxyphenylboronic Acid (CAS# 913835-74-2) is a useful research chemical.
Molecular Weight:	155.92
Molecular Formula:	C6H6FO3B
Canonical SMILES:	B(C1=CC(=C(C=C1)F)O)(O)O
InChI:	InChI=1S/C6H6BFO3/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,9-11H
InChI Key:	GNCXNRGBOBWFSO-UHFFFAOYSA-N
Boiling Point:	334.7 °C at 760 mmHg
Density:	1.42 g/cm³
MDL:	MFCD08689483
LogP:	-0.78890

Publication Number	Title	Priority Date
CN-111146496-A	Polymer electrolyte and lithium ion battery containing same	20191223
CN-111146496-B	Polymer electrolyte and lithium ion battery containing same	20191223
WO-2020150307-A1	Phosphonate conjugates and uses thereof	20190115
WO-2020123395-A1	2-oxoquinazoline derivatives as methionine adenosyltransferase 2a inhibitors	20181210
TW-202039487-A	2-oxoquinazoline derivatives as methionine adenosyltransferase 2a inhibitors	20181210

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Related Functional Groups

Boronic Acids and Esters

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2-(7,8-Difluoro-1-naphthyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
[1256355-43-7]
2-(Methoxycarbonyl)-4-methylphenylboronic Acid
[766549-26-2]
2-Chloro-4-hydroxyphenylboronic Acid
[871126-22-6]
2-Fluoro-4-formylphenylboronic acid
[881302-73-4]
3,5-Dicarboxyphenylboronic Acid
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4-(4-Piperidyl)phenylboronic Acid

GHS Hazard Statement:	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	133
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	156.0394024
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	156.0394024
Rotatable Bond Count:	1
Topological Polar Surface Area:	60.7 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0