2-Chloro-4,6-difluorophenylboronic Acid - CAS 1373393-48-6

Catalog:	BB008548
Product Name:	2-Chloro-4,6-difluorophenylboronic Acid
CAS:	1373393-48-6
Synonyms:	(2-chloro-4,6-difluorophenyl)boronic acid; (2-chloro-4,6-difluorophenyl)boronic acid

Technical Data

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Patents

Computed Properties

IUPAC Name:	(2-chloro-4,6-difluorophenyl)boronic acid
Description:	2-Chloro-4,6-difluorophenylboronic Acid (CAS# 1373393-48-6) is a useful research chemical.
Molecular Weight:	192.36
Molecular Formula:	C6H4ClF2O2B
Canonical SMILES:	B(C1=C(C=C(C=C1Cl)F)F)(O)O
InChI:	InChI=1S/C6H4BClF2O2/c8-4-1-3(9)2-5(10)6(4)7(11)12/h1-2,11-12H
InChI Key:	CVKSBWKPNRLZGR-UHFFFAOYSA-N

Publication Number	Title	Priority Date
EP-2558577-A1	Bi-functional complexes and methods for making and using such complexes	20100416
WO-2011127933-A1	Bi-functional complexes and methods for making and using such complexes	20100416
US-2010069417-A1	Novel phenyl(4-phenylpyrimidin-2-yl)amine derivatives, their preparation, as medicaments, pharmaceutical compositions and in particular as ikk inhibitors	20070105

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Related Functional Groups

Boronic Acids and Esters

[380430-53-5]
2-Ethoxycarbonylphenylboronic Acid
[163105-90-6]
2-Methoxy-3-pyridylboronic Acid
[355836-10-1]
2-Methoxy-4-(trifluoromethoxy)phenylboronic Acid
[470478-90-1]
4-(4-Boc-piperazino)phenylboronic Acid Pinacol Ester
[850623-36-8]
Potassium (4-Cyanophenyl)trifluoroborate
[1029439-85-7]
2,3-Difluoro-4-hydroxyphenylboronic Acid Pinacol Ester

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
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

Complexity:	161
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	191.9960936
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	191.9960936
Rotatable Bond Count:	1
Topological Polar Surface Area:	40.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0