2-Methyl-5-(methylsulfonyl)phenylboronic Acid Pinacol Ester - CAS 909187-44-6

Name: 2-Methyl-5-(methylsulfonyl)phenylboronic Acid Pinacol Ester
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB039989
Product Name:	2-Methyl-5-(methylsulfonyl)phenylboronic Acid Pinacol Ester
CAS:	909187-44-6
Synonyms:	4,4,5,5-tetramethyl-2-(2-methyl-5-methylsulfonylphenyl)-1,3,2-dioxaborolane; 4,4,5,5-tetramethyl-2-(2-methyl-5-methylsulfonylphenyl)-1,3,2-dioxaborolane

Technical Data

IUPAC Name:	4,4,5,5-tetramethyl-2-(2-methyl-5-methylsulfonylphenyl)-1,3,2-dioxaborolane
Description:	2-Methyl-5-(methylsulfonyl)phenylboronic Acid Pinacol Ester (CAS# 909187-44-6 ) is a useful research chemical.
Molecular Weight:	296.19
Molecular Formula:	C14H21O4SB
Canonical SMILES:	B1(OC(C(O1)(C)C)(C)C)C2=C(C=CC(=C2)S(=O)(=O)C)C
InChI:	InChI=1S/C14H21BO4S/c1-10-7-8-11(20(6,16)17)9-12(10)15-18-13(2,3)14(4,5)19-15/h7-9H,1-6H3
InChI Key:	XIQIRNMWMQVDKJ-UHFFFAOYSA-N
LogP:	2.77850

Publication Number	Title	Priority Date
TW-201803871-A	Heterocyclic compound as PI3K-Î³ inhibitor	20160624
US-10138248-B2	Substituted imidazo[2,1-f][1,2,4]triazines, substituted imidazo[1,2-a]pyridines, substituted imidazo[1,2-b]pyridazines and substituted imidazo[1,2-a]pyrazines as PI3K-Î³ inhibitors	20160624
US-10479795-B2	Substituted imidazo[2,1-f][1,2,4]triazines, substituted imidazo[1,2-a]pyridines and substituted imidazo[1,2-b]pyridazines as PI3K-gamma inhibitors	20160624
US-2018009816-A1	HETEROCYCLIC COMPOUNDS AS PI3K-y INHIBITORS	20160624
US-2019119287-A1	HETEROCYCLIC COMPOUNDS AS PI3K-y INHIBITORS	20160624

Complexity:	450
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	296.1253605
Formal Charge:	0
Heavy Atom Count:	20
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	296.1253605
Rotatable Bond Count:	2
Topological Polar Surface Area:	61
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0