AG00CKU0

374794-77-1 | N-Boc-3-Methylpiperidin-4-one

AG00CKU0

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CAS Number	374794-77-1
Catalog Number	AG00CKU0(AGN-PC-0WAJ5G)
Chemical Name	N-Boc-3-Methylpiperidin-4-one
IUPAC Name	tert-butyl 4-methyl-3-oxopiperidine-1-carboxylate
InChI	InChI=1S/C11H19NO3/c1-8-5-6-12(7-9(8)13)10(14)15-11(2,3)4/h8H,5-7H2,1-4H3
InChI Key	SOJRRCWSZXYEQN-UHFFFAOYSA-N
MDL Number	MFCD11520576
Molecular Formula	C11H19NO3
Molecular Weight	213.2735
SMILES	C(=O)(OC(C)(C)C)N1CC(=O)C(CC1)C
Synonyms	tert-butyl 4-methyl-3-oxopiperidine-1-carboxylate, 374794-77-1, 1-Boc-4-methyl-piperidin-3-one, SCHEMBL5765921, 1-Boc-4-Methyl-3-oxopiperidine, 4606AJ, MFCD11520576, AKOS015996809, MCULE-8103546068, NE27449, AS-32903, CS-0054007, KS-00000497, Z1623877892, 4-Methyl-3-oxo-piperidine-1-carboxylic acid tert-butyl ester, 1-Piperidinecarboxylic acid, 4-methyl-3-oxo-, 1,1-dimethylethyl ester, N-Boc-3-Methylpiperidin-4-one, C11H19NO3,

Complexity	268
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	213.136g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	213.277g/mol
Monoisotopic Mass	213.136g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	46.6A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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