AG003I29

Name: 3-(3-Chloro-phenyl)-3-cyano-2-oxo-propionic acid ethyl ester
Brand: Angene Chemical
SKU: AG003I29

38747-02-3 | 3-(3-Chloro-phenyl)-3-cyano-2-oxo-propionic acid ethyl ester

AG003I29

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CAS Number	38747-02-3
Catalog Number	AG003I29(AGN-PC-0WA7AI)
Chemical Name	3-(3-Chloro-phenyl)-3-cyano-2-oxo-propionic acid ethyl ester
IUPAC Name	ethyl 3-(3-chlorophenyl)-3-cyano-2-oxopropanoate
InChI	InChI=1S/C12H10ClNO3/c1-2-17-12(16)11(15)10(7-14)8-4-3-5-9(13)6-8/h3-6,10H,2H2,1H3
InChI Key	QUFNXWLCJNRBFC-UHFFFAOYSA-N
MDL Number	MFCD16327924
Molecular Formula	C12H10ClNO3
Molecular Weight	251.6657
SMILES	O=C(OCC)C(C(C1=CC=CC(Cl)=C1)C#N)=O
Synonyms	38747-02-3, ethyl 3-(3-chlorophenyl)-3-cyano-2-oxopropanoate, 3-(3-Chloro-phenyl)-3-cyano-2-oxo-propionic acid ethyl ester, ACMC-20e0un, SCHEMBL9585644, CTK4I0419, DTXSID20599729, KS-000002GW, 1960AJ, MFCD16327924, AKOS015838718, MCULE-8661026689, RP28966, RTX-012649, AK157336, AX8291438, J-510601, Benzenepropanoic acid, 3-chloro-beta-cyano-alpha-oxo-, ethyl ester, C12H10ClNO3, 2-HYDROXY-1-(4-IODOPHENYL)ETHANONE,

Complexity	347
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	251.035g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	251.666g/mol
Monoisotopic Mass	251.035g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	67.2A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.6

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