AG0032AL

39514-19-7 | 1-Benzyl-3-oxo-piperidine-4-carboxylic acid ethyl ester

AG0032AL

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CAS Number	39514-19-7
Catalog Number	AG0032AL(AGN-PC-0JQZRX)
Chemical Name	1-Benzyl-3-oxo-piperidine-4-carboxylic acid ethyl ester
IUPAC Name	ethyl 1-benzyl-3-oxopiperidine-4-carboxylate
InChI	InChI=1S/C15H19NO3/c1-2-19-15(18)13-8-9-16(11-14(13)17)10-12-6-4-3-5-7-12/h3-7,13H,2,8-11H2,1H3
InChI Key	JYFGIESQUYQLGM-UHFFFAOYSA-N
MDL Number	MFCD00044512
Molecular Formula	C15H19NO3
Molecular Weight	261.3163
SMILES	C(C1=CC=CC=C1)N1CC(C(CC1)C(=O)OCC)=O
Synonyms	Ethyl 1-benzyl-3-oxopiperidine-4-carboxylate, 39514-19-7, 1-Benzyl-3-oxo-piperidine-4-carboxylic acid ethyl ester, Ethyl 1-benzyl-3-oxo-piperidine-4-carboxylate, CHEMBL2316604, Ethyl1-benzyl-3-oxo-piperidine-4-carboxylate, 4-Piperidinecarboxylic acid, 3-oxo-1-(phenylmethyl)-, ethyl ester, EN300-29856, Ethyl N-benzyl-3-oxopiperidine-4-carboxylate hydrochloride, EINECS 254-482-4, N-Benzyl-4-carbethoxy-3-piperidone, Cyto2C7, PubChem24085, AC1Q34LY, SCHEMBL184071, AC1L9I85, CTK4I1461, JYFGIESQUYQLGM-UHFFFAOYSA-N, HMS1661N14, ALBB-009330, BCP19270, CS-D0518, ZX-AN008196, ZX-RL000401, EINECS 258-162-5, ANW-45216, BBL018063, BDBM50426134, CCG-52745, CE-640, MFCD00044512, STL140926, AKOS005067676, ACN-032194, MB00417, MCULE-7333713085, RP29308, RP29310, SDCCGMLS-0065899.P001, AC-24582, AK-30327, BR-30327, OR301117, SC-22197, AB0024666, AX8056707, DB-012395, ST2419278, TL8002853, TX-012344, A6611, AM20120510, FT-0649162, W5985, Ethyl 1-benzyl-3-oxo-4-piperidinecarboxylate, C-5453, 763B210, ethyl 3-oxo-1-phenylmethyl-4-piperidinecarboxylate, I12-0065, J-520518, SR-01000641956-1, ETHYL N-BENZYL-3-OXO-4-PIPERIDINE-CARBOXYLATE, 1-Benzyl-3-oxopiperidine-4-carboxylic acid ethyl ester, F8889-9235, Z1250132254, 1-BENZYL-3-OXO-PIPERIDINE-4-CARBOXYLIC ACID ETHYL, 4-Piperidinecarboxylicacid, 3-oxo-1-(phenylmethyl)-, ethyl ester, 4-piperidinecarboxylic acid, 3-oxo-1-(phenylmethyl)-, ethyl ester, hydrochloride, C15H19NO3, C15-H19-N-O3, CID419705, NSC117336, 1-Benzyl-3-oxo-piperidine-4-carboxylic, 52763-21-0, Ethyl N-benzyl-3-oxo-4-piperidine-carboxylate hydrochloride,

Complexity	323
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	261.136g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	261.321g/mol
Monoisotopic Mass	261.136g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	46.6A^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-H317-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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