AG00HTTU

1349734-00-4 | 1-Ethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2(1H)-one

AG00HTTU

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CAS Number	1349734-00-4
Catalog Number	AG00HTTU(AGN-PC-0WCYD3)
Chemical Name	1-Ethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2(1H)-one
IUPAC Name	1-ethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-one
InChI	InChI=1S/C13H20BNO3/c1-6-15-9-10(7-8-11(15)16)14-17-12(2,3)13(4,5)18-14/h7-9H,6H2,1-5H3
InChI Key	GARRLDCODNEYEC-UHFFFAOYSA-N
MDL Number	MFCD27959317
Molecular Formula	C13H20BNO3
Molecular Weight	249.1138
SMILES	CC1(C)OB(OC1(C)C)c1cn(CC)c(=O)cc1
Synonyms	1349734-00-4, 1-Ethyl-6-oxo-1,6-dihydropyridine-3-boronic Acid Pinacol Ester, 1-ethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2(1H)-one, SCHEMBL506778, MFCD27959317, ZINC203589810, CS-11980, SY034571, FT-0742587, MFCD27959317 (95%), 2(1H)-pyridinone,1-ethyl-5-(4,4,5,5,tetramethyl-1,3,2-dioxaborolan-2-yl), 1-ethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-one,

Complexity	410
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	249.154g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	249.117g/mol
Monoisotopic Mass	249.154g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	38.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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