AG009EQP

Name: rac trans-4-Cotinine Carboxylic Acid Methyl Ester
Brand: Angene Chemical
SKU: AG009EQP

135028-97-6 | rac trans-4-Cotinine Carboxylic Acid Methyl Ester

AG009EQP

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CAS Number	135028-97-6
Catalog Number	AG009EQP(AGN-PC-0WBNA2)
Chemical Name	rac trans-4-Cotinine Carboxylic Acid Methyl Ester
IUPAC Name	methyl (2R,3S)-1-methyl-5-oxo-2-pyridin-3-ylpyrrolidine-3-carboxylate
InChI	InChI=1S/C12H14N2O3/c1-14-10(15)6-9(12(16)17-2)11(14)8-4-3-5-13-7-8/h3-5,7,9,11H,6H2,1-2H3/t9-,11-/m0/s1
InChI Key	LXSYCOKNUBLDNJ-ONGXEEELSA-N
Molecular Formula	C12H14N2O3
Molecular Weight	234.2512
SMILES	COC(=O)[C@H]1CC(=O)N(C)[C@H]1c2cccnc2
Synonyms	135028-97-6, rac trans-4-Cotinine Carboxylic Acid Methyl Ester, DTXSID80747380, ZINC77286051, Methyl (2R,3S)-1-methyl-5-oxo-2-(pyridin-3-yl)pyrrolidine-3-carboxylate, (2R,3R)-rel-1-Methyl-5-oxo-2-(3-pyridinyl)-3-pyrrolidinecarboxylic Acid Methyl Ester, trans-1-Methyl-5-oxo-2-(3-pyridinyl)-3-pyrrolidinecarboxylic Acid Methyl Ester, LXSYCOKNUBLDNJ-ONGXEEELSA-N,

Complexity	319
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	234.1g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	234.255g/mol
Monoisotopic Mass	234.1g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	59.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.3

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited