AG003A16

4720-64-3 | 4-Methylpiperidin-2-one

AG003A16

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CAS Number	4720-64-3
Catalog Number	AG003A16(AGN-PC-0WD6QU)
Chemical Name	4-Methylpiperidin-2-one
IUPAC Name	4-methylpiperidin-2-one
InChI	InChI=1S/C6H11NO/c1-5-2-3-7-6(8)4-5/h5H,2-4H2,1H3,(H,7,8)
InChI Key	PTSGHGGLRADEFP-UHFFFAOYSA-N
MDL Number	MFCD13178698
Molecular Formula	C6H11NO
Molecular Weight	113.1576
SMILES	CC1CC(NCC1)=O
Synonyms	4-methylpiperidin-2-one, 4720-64-3, 4-methyl-2-piperidone, 2-Piperidinone, 4-methyl-, 4-methylpiperidone, 4-methyl-2-oxo-piperidine, SCHEMBL316267, 2-?piperidinone, 4-?methyl-, PTSGHGGLRADEFP-UHFFFAOYSA-N, KS-000008RH, MFCD13178698, AKOS006348500, MCULE-8903018599, NE25150, AK170550, AS-50976, SC-65553, CS-0052341, FT-0721281, Z1436472912, 4-methyl-2-Piperidinone,

Complexity	101
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	113.084g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	113.16g/mol
Monoisotopic Mass	113.084g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	29.1A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H225
Packing Group	Ⅲ
Precautionary statements	P210-P273-P243-P403
UN Code	UN 1993

Certificate of Analysis

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