2,4-Dimethylpyridine-3-boronic Acid Pinacol Ester - CAS 1421252-89-2

Catalog:	BB009301
Product Name:	2,4-Dimethylpyridine-3-boronic Acid Pinacol Ester
CAS:	1421252-89-2
Synonyms:	2,4-dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine; 2,4-dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2,4-dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
Description:	2,4-Dimethylpyridine-3-boronic Acid Pinacol Ester (CAS# 1421252-89-2 ) is a useful research chemical.
Molecular Weight:	233.11
Molecular Formula:	C13H20NO2B
Canonical SMILES:	B1(OC(C(O1)(C)C)(C)C)C2=C(C=CN=C2C)C
InChI:	InChI=1S/C13H20BNO2/c1-9-7-8-15-10(2)11(9)14-16-12(3,4)13(5,6)17-14/h7-8H,1-6H3
InChI Key:	IJYILPGEZFUJON-UHFFFAOYSA-N
LogP:	1.99760

Publication Number	Title	Priority Date
CN-110678466-A	Naphthyridines as HPK1 inhibitors	20170330
KR-20190136028-A	Naphthyridine as an HPK1 Inhibitor	20170330
TW-201904964-A	Acridine as an inhibitor of HPK1	20170330
US-10407424-B2	Naphthyridines as inhibitors of HPK1	20170330
US-2018282328-A1	Naphthyridines as inhibitors of hpk1	20170330

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Related Functional Groups

Boronic Acids and Esters

[1022092-33-6]
1-(2-Cyanoethyl)-1H-pyrazole-4-boronic Acid Pinacol Ester
[1256355-43-7]
2-(Methoxycarbonyl)-4-methylphenylboronic Acid
[1219956-23-6]
2,4-Diphenyl-6-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3,5-triazine
[380430-53-5]
2-Ethoxycarbonylphenylboronic Acid
[355836-10-1]
2-Methoxy-4-(trifluoromethoxy)phenylboronic Acid
[881302-73-4]
3,5-Dicarboxyphenylboronic Acid

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	277
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	233.1587090
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	233.1587090
Rotatable Bond Count:	1
Topological Polar Surface Area:	31.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0