AG001XDD

167414-75-7 | Benzyl 4-(3-Ethoxy-3-Oxopropanoyl)Piperidine-1-Carboxylate

AG001XDD

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CAS Number	167414-75-7
Catalog Number	AG001XDD(AGN-PC-0N4N4J)
Chemical Name	Benzyl 4-(3-Ethoxy-3-Oxopropanoyl)Piperidine-1-Carboxylate
IUPAC Name	benzyl 4-(3-ethoxy-3-oxopropanoyl)piperidine-1-carboxylate
InChI	InChI=1S/C18H23NO5/c1-2-23-17(21)12-16(20)15-8-10-19(11-9-15)18(22)24-13-14-6-4-3-5-7-14/h3-7,15H,2,8-13H2,1H3
InChI Key	HSYRPXCJJXOCKE-UHFFFAOYSA-N
MDL Number	MFCD04115570
Molecular Formula	C18H23NO5
Molecular Weight	333.3789
SMILES	O=C(N1CCC(C(CC(OCC)=O)=O)CC1)OCC2=CC=CC=C2
Synonyms	167414-75-7, benzyl 4-(3-ethoxy-3-oxopropanoyl)piperidine-1-carboxylate, 4-(2-ethoxycarbonyl-acetyl)-piperidine-1-carboxylic acid benzyl ester, 3-Oxo-3-(1-Cbz-piperidin-4-yl)-propionic acid ethyl ester, ETHYL 3-(N-CBZ-4-PIPERIDYL)-3-OXOPROPANOATE, ETHYL 3-(N-CBZ-PIPERIDIN-4-YL)-3-OXOPROPANOATE, AK-64003, ethyl 3-(1-cbz-piperidin-4-yl)-3-oxopropanoate, HSYRPXCJJXOCKE-UHFFFAOYSA-N, SCHEMBL1162669, CTK4D2655, DTXSID10440155, KS-00000BF3, 5921AJ, MFCD04115570, ZINC15442633, AKOS015904069, AB20257, CS-W003186, TRA-0195094, AJ-67409, CJ-15121, DS-15326, SC-49546, SY005600, AB0056229, AB1000522, AX8088709, DB-018085, TC-308231, Ethyl3-(N-Cbz-4-piperidyl)-3-oxopropanoate, FT-0769978, K-5184, MFCD04115570 (97+%), ethyl 3-(n-cbz-piperidin-4-yl)-3-oxopropanoate, I14-17560, n-cbz-4-piperidinepropanoic acid,beta-oxo-,ethyl ester, 3-oxo-3-(1-cbz-piperidin-4-yl)-propionic acidethyl ester, 4-(2-ethoxycarbonylacetyl)piperidine-1-carboxylic acid benzyl ester, 4-Piperidinepropanoicacid, b-oxo-1-[(phenylmethoxy)carbonyl]-,ethyl ester, 4-Piperidinepropanoic acid, beta-oxo-1-[(phenylmethoxy)carbonyl]-, ethyl ester, null, C18H23NO5, CID10449485, 4-(2-ethoxycarbonyl-acetyl)-piperidine-1-carboxyli, Benzyl 4-(2-ethoxycarbonylacetyl)piperidine-1-carboxylate, 38711-20-5,

Complexity	437
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	333.158g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	333.384g/mol
Monoisotopic Mass	333.158g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	72.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

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

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