2,6-Dichlorophenylboronic Acid - CAS 73852-17-2

Catalog:	BB034938
Product Name:	2,6-Dichlorophenylboronic Acid
CAS:	73852-17-2
Synonyms:	(2,6-dichlorophenyl)boronic acid; (2,6-dichlorophenyl)boronic acid

Technical Data

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Computed Properties

IUPAC Name:	(2,6-dichlorophenyl)boronic acid
Description:	2,6-Dichlorophenylboronic Acid (CAS# 73852-17-2) is a useful research chemical.
Molecular Weight:	190.82
Molecular Formula:	C6H5Cl2O2B
Canonical SMILES:	B(C1=C(C=CC=C1Cl)Cl)(O)O
InChI:	InChI=1S/C6H5BCl2O2/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3,10-11H
InChI Key:	CXDPUSMFYPQXCV-UHFFFAOYSA-N
Boiling Point:	341.8 °C at 760 mmHg
Density:	1.47 g/cm³
MDL:	MFCD00064869
LogP:	0.67320

Publication Number	Title	Priority Date
CN-112047971-A	Preparation method of 2, 6-dichlorobenzene boric acid	20201010
KR-20210083464-A	Organic electroluminescence device and polycyclic compound for organic electroluminescence device	20191226
US-2021202861-A1	Organic electroluminescence device and polycyclic compound for organic electroluminescence device	20191226
US-2021171535-A1	Tricyclic heterocycles as fgfr inhibitors	20191204
WO-2021113479-A1	Tricyclic heterocycles as fgfr inhibitors	20191204

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GHS Hazard Statement:	H315 (22.45%): 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:	124
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	189.9759650
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	189.9759650
Rotatable Bond Count:	1
Topological Polar Surface Area:	40.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0