AG001B4F

1394935-52-4 | Carbamic acid, N-(1,6-dihydro-6-oxo-3-pyridinyl)-, 1,1-dimethylethyl ester

AG001B4F

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CAS Number	1394935-52-4
Catalog Number	AG001B4F(AGN-PC-0WBRLX)
Chemical Name	Carbamic acid, N-(1,6-dihydro-6-oxo-3-pyridinyl)-, 1,1-dimethylethyl ester
IUPAC Name	tert-butyl N-(6-oxo-1H-pyridin-3-yl)carbamate
InChI	InChI=1S/C10H14N2O3/c1-10(2,3)15-9(14)12-7-4-5-8(13)11-6-7/h4-6H,1-3H3,(H,11,13)(H,12,14)
InChI Key	YISSDDUTPCTXBW-UHFFFAOYSA-N
MDL Number	MFCD27986955
Molecular Formula	C10H14N2O3
Molecular Weight	210.2298
SMILES	O=C(OC(C)(C)C)NC(C=C1)=CNC1=O
Synonyms	1394935-52-4, tert-butyl N-(6-oxo-1,6-dihydropyridin-3-yl)carbamate, tert-Butyl (6-oxo-1,6-dihydropyridin-3-yl)carbamate, (6-Oxo-1,6-dihydro-pyridin-3-yl)-carbamic acid tert-butyl ester, tert-Butyl N-(6-oxo-1H-pyridin-3-yl)carbamate, KS-000004FD, MFCD27986955, ZINC96372374, AKOS025290954, SB11542, AS-33984, CS-0048055, (6-oxo-1,6-dihydro-pyridin-3-yl)-carbamic acid tert-butyl ester, AldrichCPR, Carbamic acid, N-(1,6-dihydro-6-oxo-3-pyridinyl)-, 1,1-dimethylethyl ester,

Complexity	337
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	210.1g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	210.233g/mol
Monoisotopic Mass	210.1g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	67.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302
Precautionary statements	P280-P305+P351+P338

Certificate of Analysis

Lot Number