3'-Chlorobiphenyl-3-boronic Acid - CAS 1107603-42-8

Catalog:	BB002667
Product Name:	3'-Chlorobiphenyl-3-boronic Acid
CAS:	1107603-42-8
Synonyms:	[3-(3-chlorophenyl)phenyl]boronic acid; [3-(3-chlorophenyl)phenyl]boronic acid

Technical Data

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Computed Properties

IUPAC Name:	[3-(3-chlorophenyl)phenyl]boronic acid
Description:	3'-Chlorobiphenyl-3-boronic Acid (CAS# 1107603-42-8 ) is a useful research chemical.
Molecular Weight:	232.47
Molecular Formula:	C12H10ClO2B
Canonical SMILES:	B(C1=CC(=CC=C1)C2=CC(=CC=C2)Cl)(O)O
InChI:	InChI=1S/C12H10BClO2/c14-12-6-2-4-10(8-12)9-3-1-5-11(7-9)13(15)16/h1-8,15-16H
InChI Key:	JMYLBKPHIHRJDY-UHFFFAOYSA-N
LogP:	1.68680

Publication Number	Title	Priority Date
CN-112442023-A	Heterocyclic derivative and organic electroluminescent device thereof	20201130
CN-112442023-B	Heterocyclic derivative and organic electroluminescent device thereof	20201130
US-2021206741-A1	Nitrogen-containing compound, electronic element and electronic device	20191231
US-2021130313-A1	Nitrogen-containing compound, electronic component and electronic device	20191031
US-11098022-B2	Nitrogen-containing compound, electronic component and electronic device	20191031

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Complexity:	225
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	232.0462374
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	232.0462374
Rotatable Bond Count:	2
Topological Polar Surface Area:	40.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0