2-(3,5-Dimethyl-1-pyrazolyl)-4-methylphenylboronic Acid - CAS 1287753-41-6

Name: 2-(3,5-Dimethyl-1-pyrazolyl)-4-methylphenylboronic Acid
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB006931
Product Name:	2-(3,5-Dimethyl-1-pyrazolyl)-4-methylphenylboronic Acid
CAS:	1287753-41-6
Synonyms:	[2-(3,5-dimethyl-1-pyrazolyl)-4-methylphenyl]boronic acid; [2-(3,5-dimethylpyrazol-1-yl)-4-methylphenyl]boronic acid

Technical Data

IUPAC Name:	[2-(3,5-dimethylpyrazol-1-yl)-4-methylphenyl]boronic acid
Description:	2-(3,5-Dimethyl-1-pyrazolyl)-4-methylphenylboronic Acid (CAS# 1287753-41-6) is a useful research chemical.
Molecular Weight:	230.07
Molecular Formula:	C12H15N2O2B
Canonical SMILES:	B(C1=C(C=C(C=C1)C)N2C(=CC(=N2)C)C)(O)O
InChI:	InChI=1S/C12H15BN2O2/c1-8-4-5-11(13(16)17)12(6-8)15-10(3)7-9(2)14-15/h4-7,16-17H,1-3H3
InChI Key:	PBNRTWNGRDPMFC-UHFFFAOYSA-N
MDL:	MFCD08059989
LogP:	0.47730

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

Complexity:	265
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	230.1226579
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	230.1226579
Rotatable Bond Count:	2
Topological Polar Surface Area:	58.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0