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4-Cyano-2-methylphenylboronic Acid

4-Cyano-2-methylphenylboronic Acid - CAS 313546-18-8

Catalog:	BB020894
Product Name:	4-Cyano-2-methylphenylboronic Acid
CAS:	313546-18-8
Synonyms:	(4-cyano-2-methylphenyl)boronic acid; (4-cyano-2-methylphenyl)boronic acid

4-Cyano-2-methylphenylboronic Acid

Technical Data

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Computed Properties

IUPAC Name:	(4-cyano-2-methylphenyl)boronic acid
Description:	Reactant involved in: Reactions with (cyanomethylphenyl)boronic acid; Synthesis of oligo-boronic acid receptors with improved structural and electronic properties; Syntesis of aminoalkoxybiphenylnitriles for use as histamine-3 receptor ligands.
Molecular Weight:	160.97
Molecular Formula:	C8H8NO2B
Canonical SMILES:	B(C1=C(C=C(C=C1)C#N)C)(O)O
InChI:	InChI=1S/C8H8BNO2/c1-6-4-7(5-10)2-3-8(6)9(11)12/h2-4,11-12H,1H3
InChI Key:	RGCVYEOTYJCNOS-UHFFFAOYSA-N
Boiling Point:	376.106 °C at 760 mmHg
Melting Point:	287-305 °C
Flash Point:	Not applicable
Purity:	≥ 95 %
Density:	1.209 g/cm³
Appearance:	Solid
MDL:	MFCD09750473
LogP:	-0.45352

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