5-Fluoro-2-hydroxyphenylboronic Acid - CAS 259209-20-6

Catalog:	BB019073
Product Name:	5-Fluoro-2-hydroxyphenylboronic Acid
CAS:	259209-20-6
Synonyms:	(5-fluoro-2-hydroxyphenyl)boronic acid; (5-fluoro-2-hydroxyphenyl)boronic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	(5-fluoro-2-hydroxyphenyl)boronic acid
Description:	5-Fluoro-2-hydroxyphenylboronic Acid (CAS# 259209-20-6) is a useful research chemical.
Molecular Weight:	155.92
Molecular Formula:	C6H6FO3B
Canonical SMILES:	B(C1=C(C=CC(=C1)F)O)(O)O
InChI:	InChI=1S/C6H6BFO3/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,9-11H
InChI Key:	TWDQSJDFXUMAOI-UHFFFAOYSA-N
Boiling Point:	323.2 °C at 760 mmHg
Density:	1.42 g/cm³
MDL:	MFCD03095357
LogP:	-0.78890

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Related Functional Groups

Boronic Acids and Esters

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2-Chloro-4-hydroxyphenylboronic Acid
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Potassium (2-Chloro-5-pyrimidinyl)trifluoroborate
[850623-36-8]
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[1256358-61-8]
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B-spiro[9H-fluorene-9,9'-[9H]xanthen]-2-ylboronic 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