2-(2-Nitrobenzylidene)-3-oxobutanoic Acid, Methyl Ester

methyl (2Z)-2-[(2-nitrophenyl)methylidene]-3-oxobutanoate

Also Known As: Nifedipine Impurity 56|Nifedipine Impurity C|Nifedipine EP Impurity C|Nifedipine EP Impurity C (Z-Isomer)|Methyl 2-(2-nitrobenzylidene)acetoacetate|methyl 2-nitrobenzylideneacetoacetate|s11915|EC 810-021-4|2'-nitrobenzylideneacetoacetic acid methyl ester|2-(2-Nitrobenzylidene)-3-oxobutanoic Acid, Methyl Ester|NIFEDIPINE IMPURITY C [EP IMPURITY]|methyl 2-[(2-nitrophenyl)methylidene]-3-oxobutanoate|J1.836.643F|Methyl (Z)-2-(2-nitrobenzylidene)-3-oxobutanoate|methyl 2-(2-nitrobenzylidene)-3-oxobutanoate|(Z)-methyl 2-(2-nitrobenzylidene)-3-oxobutanoate|alpha-Acetyl-2-nitrobenzenepropenoic acid methyl ester|methyl (2Z)-2-[(2-nitrophenyl)methylidene]-3-oxobutanoate|Butanoic acid, 2-((2-nitrophenyl)methylene)-3-oxo-, methyl ester, (2Z)-|Butanoic acid, 2-[(2-nitrophenyl)methylene]-3-oxo-, methyl ester, (2Z)-|(Z)-2-Acetyl-3-(2-nitrophenyl)propenoic acid methyl ester|Methyl (2Z)-2-[(2-nitrophenyl)methylene]-3-oxobutanoate|3-Oxo-2-[(Z)-2-nitrobenzylidene]butanoic acid methyl ester|METHYL (2Z)-2-((2-NITROPHENYL)METHYLENE)-3-OXOBUTANOATE|BUTANOIC ACID, 2-((2-NITROPHENYL)METHYLENE)-3-OXO-, METHYL ESTER, (Z)-

Molecular Formula	C12H11NO5
Molecular Weight	249.06372 g/mol
LogP	1.7
Topological Polar Surface Area	89.2 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	249.06372
Monoisotopic Mass	249.06372
Heavy Atoms	18
Complexity	382.0

Chemical Identifiers

CAS Number	3983-75-3
SMILES	CC(=O)/C(=C/C1=CC=CC=C1[N+](=O)[O-])/C(=O)OC
InChIKey	APKKCRAKPMSAEI-YFHOEESVSA-N