AG000FAC

114812-34-9 | 2-Pyrrolidinecarboxamide, 1-ethyl-, (2S)-

AG000FAC

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CAS Number	114812-34-9
Catalog Number	AG000FAC(AGN-PC-0NYKEJ)
Chemical Name	2-Pyrrolidinecarboxamide, 1-ethyl-, (2S)-
IUPAC Name	(2S)-1-ethylpyrrolidine-2-carboxamide
InChI	InChI=1S/C7H14N2O/c1-2-9-5-3-4-6(9)7(8)10/h6H,2-5H2,1H3,(H2,8,10)/t6-/m0/s1
InChI Key	LQOASEHNECNLNM-LURJTMIESA-N
MDL Number	MFCD00191361
Molecular Formula	C7H14N2O
Molecular Weight	142.1989
SMILES	CCN1CCC[C@H]1C(N)=O
Synonyms	(S)-(-)-1-Ethyl-2-pyrrolidinecarboxamide, 114812-34-9, (S)-1-ethylpyrrolidine-2-carboxamide, (S)-1-ethyl-2-pyrrolidinecarboxamide, 1-ethylprolinamide, SCHEMBL1530965, CTK6E9973, LQOASEHNECNLNM-LURJTMIESA-N, ANW-16715, MFCD00191361, ZINC34539877, AKOS006237184, AKOS015838665, FS-5648, RTR-002698, (S)-1-Ethyl-2-pyrrolidine carboxamide, (-)-(S)-1-Ethyl-2-pyrrolidinecarboxamide, TR-002698, [2S,(?)]-1-Ethyl-2-pyrrolidinecarboxamide, E0452, KS-00001512, J-003138, N-Ethyl-L-prolinamide, (R)-1-Ethyl-2-pyrrolidinecarboxamide, CID10866443, 2-Pyrrolidinecarboxamide, 1-ethyl-, (2S)-,

Complexity	136
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	142.111g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	142.202g/mol
Monoisotopic Mass	142.111g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	46.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
UN Code

Certificate of Analysis

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