4-Methyl-2-(1-pyrazolyl)phenylboronic Acid - CAS 1287753-43-8

Catalog:	BB006933
Product Name:	4-Methyl-2-(1-pyrazolyl)phenylboronic Acid
CAS:	1287753-43-8
Synonyms:	[4-methyl-2-(1-pyrazolyl)phenyl]boronic acid; (4-methyl-2-pyrazol-1-ylphenyl)boronic acid

Technical Data

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Computed Properties

IUPAC Name:	(4-methyl-2-pyrazol-1-ylphenyl)boronic acid
Description:	4-Methyl-2-(1-pyrazolyl)phenylboronic Acid (CAS# 1287753-43-8) is a useful research chemical.
Molecular Weight:	202.02
Molecular Formula:	C10H11N2O2B
Canonical SMILES:	B(C1=C(C=C(C=C1)C)N2C=CC=N2)(O)O
InChI:	InChI=1S/C10H11BN2O2/c1-8-3-4-9(11(14)15)10(7-8)13-6-2-5-12-13/h2-7,14-15H,1H3
InChI Key:	BFWQHIWBRDBMQI-UHFFFAOYSA-N
Flash Point:	Not applicable
LogP:	-0.13950

Publication Number	Title	Priority Date
AU-2013305759-A1	Compounds for the treatment of paramoxyvirus viral infections	20120823
AU-2013305759-A2	Compounds for the treatment of paramoxyvirus viral infections	20120823
AU-2013305759-B2	Compounds for the treatment of paramoxyvirus viral infections	20120823
EP-2888240-A1	Compounds for the treatment of paramoxyvirus viral infections	20120823
EP-2888240-B1	Compounds for the treatment of paramoxyvirus viral infections	20120823

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Complexity:	216
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	202.0913578
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	202.0913578
Rotatable Bond Count:	2
Topological Polar Surface Area:	58.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0