Methyl 2-((3-nitrophenyl)methylene)-3-oxobutanoate structure

Methyl 2-((3-nitrophenyl)methylene)-3-oxobutanoate

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

Also Known As: Manidipine Benzylidene|Methyl 2-(3-nitrobenzylidene)acetoacetate|methyl 3-nitrobenzylideneacetoacetate|Methyl 2-(3-nitrobenzylidene)-3-oxobutanoate|methyl 2-[(3-nitrophenyl)methylidene]-3-oxobutanoate|Methyl 2-(3-nitrobenzylidene)-acetoacetate|methyl-2-(3-nitrobenzyliden)acetoacetate|3-Nitrobenzylidenacetessigsaeuremethylester|Methyl 2-[(3-Nitrophenyl)methylene]-3-oxobutanoate|2-(3-NITROBENZYLIDENE)ACETOACETIC ACID METHYL ESTER|Methyl 2-(3-Nitrophenylmethylene)Acetoacetate|EC 405-270-7|(Z)-methyl 2-(3-nitrobenzylidene)-3-oxobutanoate|Methyl 2-((3-nitrophenyl)methylene)-3-oxobutanoate|2-(3-nitrobenzylidene)-acetoacetic acid methyl ester|methyl (2E)-2-[(3-nitrophenyl)methylidene]-3-oxobutanoate|2-[(3-nitrophenyl)methylene]-3-oxobutanoic acid, methyl ester|Methyl 2-(3-Nitrobenzylidene)-3-oxobutanoate (1:1 E/Z Mixture)

CAS: 39512-17-9
Molecular Formula C12H11NO5
Molecular Weight 249.06372 g/mol
LogP 1.7402
Topological Polar Surface Area 86.51 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 4
Exact Mass 249.06372
Monoisotopic Mass 249.06372
Heavy Atoms 18
Complexity 533.02423

Chemical Identifiers

CAS Number 39512-17-9
SMILES CC(=O)C(=CC1=CC(=CC=C1)[N+](=O)[O-])C(=O)OC

Product Overview

Methyl 2-((3-nitrophenyl)methylene)-3-oxobutanoate (CAS 39512-17-9), with molecular formula C12H11NO5 and molecular weight 249.06372 g/mol. IUPAC: methyl 2-[(3-nitrophenyl)methylidene]-3-oxobutanoate.

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