AG00C8R5

41888-21-5 | 2-oxo-3-piperidinecarboxylic acid

AG00C8R5

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CAS Number	41888-21-5
Catalog Number	AG00C8R5(AGN-PC-098JO2)
Chemical Name	2-oxo-3-piperidinecarboxylic acid
IUPAC Name	2-oxopiperidine-3-carboxylic acid
InChI	InChI=1S/C6H9NO3/c8-5-4(6(9)10)2-1-3-7-5/h4H,1-3H2,(H,7,8)(H,9,10)
InChI Key	HQSIETYOWKHBCH-UHFFFAOYSA-N
MDL Number	MFCD08061931
Molecular Formula	C6H9NO3
Molecular Weight	143.1406
SMILES	OC(=O)C1CCCNC1=O
Synonyms	2-Oxopiperidine-3-carboxylic acid, 41888-21-5, 2-OXO-3-PIPERIDINECARBOXYLIC ACID, (3S)-2-oxopiperidine-3-carboxylic acid, 2-Oxo-piperidine-3-carboxylic acid, 3-Piperidinecarboxylic acid, 2-oxo-, (3R)-2-oxopiperidine-3-carboxylic acid, SCHEMBL55591, oxopiperidine-3-carboxylic acid, CTK1D3577, DTXSID70495888, 1448544-64-6, 1644251-80-8, ALBB-016156, 5773AB, ANW-71850, MFCD08061931, AKOS005264513, MCULE-5733950200, SB12810, TR-036763, BB 0259432, FT-0681591, 2-Oxo-3-piperidinecarboxylic acid, AldrichCPR, Y-3665, I04-5629, Z2418193610, C6H9NO3, 2-Oxo-piperidine-3-carboxylic acid, 98% - 1G 1g,

Complexity	166
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	143.058g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	143.142g/mol
Monoisotopic Mass	143.058g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	66.4A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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