4,6-Dimethylpyridine-3-boronic Acid Pinacol Ester - CAS 1622217-32-6

Catalog:	BB011849
Product Name:	4,6-Dimethylpyridine-3-boronic Acid Pinacol Ester
CAS:	1622217-32-6
Synonyms:	2,4-dimethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine; 2,4-dimethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

Technical Data

Patents

Computed Properties

IUPAC Name:	2,4-dimethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
Description:	4,6-Dimethylpyridine-3-boronic Acid Pinacol Ester (CAS# 1622217-32-6 ) is a useful research chemical.
Molecular Weight:	233.11
Molecular Formula:	C13H20NO2B
Canonical SMILES:	B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2C)C
InChI:	InChI=1S/C13H20BNO2/c1-9-7-10(2)15-8-11(9)14-16-12(3,4)13(5,6)17-14/h7-8H,1-6H3
InChI Key:	APXPNTIPURIKQY-UHFFFAOYSA-N

Publication Number	Title	Priority Date
EP-3472161-A1	Triazolopyridine compounds and uses thereof	20160620
EP-3472161-B1	Triazolopyridine compounds and uses thereof	20160620
US-10689378-B2	Triazolopyridine compounds and uses thereof	20160620
US-2019202828-A1	Triazolopyridine compounds and uses thereof	20160620
WO-2017221092-A1	Triazolopyridine compounds and uses thereof	20160620

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Complexity:	277
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	233.158709
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	233.158709
Rotatable Bond Count:	1
Topological Polar Surface Area:	31.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0