AG007HO2

32018-96-5 | 3-​Piperidinone, 4-​methyl-​1-​(phenylmethyl)​-

AG007HO2

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CAS Number	32018-96-5
Catalog Number	AG007HO2(AGN-PC-0D04H1)
Chemical Name	3-​Piperidinone, 4-​methyl-​1-​(phenylmethyl)​-
IUPAC Name	1-benzyl-4-methylpiperidin-3-one
InChI	InChI=1S/C13H17NO/c1-11-7-8-14(10-13(11)15)9-12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3
InChI Key	BSBVJNUGGBQEPO-UHFFFAOYSA-N
MDL Number	MFCD16619159
Molecular Formula	C13H17NO
Molecular Weight	203.2802
SMILES	C(N1CC(=O)C(CC1)C)c1ccccc1
Synonyms	1-benzyl-4-methylpiperidin-3-one, 32018-96-5, 1-Benzyl-4-methyl-piperidin-3-one, 4-METHYL-1-(PHENYLMETHYL)-3-PIPERIDINONE, 3-Piperidinone, 4-methyl-1-(phenylmethyl)-, MFCD16619159, SCHEMBL1105751, CTK8B9907, DTXSID00477278, BSBVJNUGGBQEPO-UHFFFAOYSA-N, 1-Benzyl-4-methyl-3-piperidinone, 1-Benzyl 4-methyl-piperidin-3-one, ANW-63520, AKOS007930647, ACN-049145, CB-2224, CM14191, AC-27439, AK-80275, EN002176, SC-52055, AB0079897, DB-068566, TC-152265, A5763, CS-0006817, FT-0720137, ST24037790, EN300-78889, B-1360, 018M965, I01-8999,

Complexity	221
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	203.131g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	203.285g/mol
Monoisotopic Mass	203.131g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	20.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.2

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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