1-Methylethyl 2-[(3-nitrophenyl)methylene]-3-oxobutanoate
CAS Registry Number®
39562-25-9
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CAS Name
1-Methylethyl 2-[(3-nitrophenyl)methylene]-3-oxobutanoateMolecular Formula
C14H15NO5Molecular Mass
277.27Cite this Page
1-Methylethyl 2-[(3-nitrophenyl)methylene]-3-oxobutanoate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=39562-25-9 (retrieved ) (CAS RN: 39562-25-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
94 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
Other Names and Identifiers
InChI
InChI=1S/C14H15NO5/c1-9(2)20-14(17)13(10(3)16)8-11-5-4-6-12(7-11)15(18)19/h4-9H,1-3H3
InChIKey
InChIKey=KSZOTXZFYCRWQK-UHFFFAOYSA-N
SMILES
C(=C(C(OC(C)C)=O)C(C)=O)C1=CC(N(=O)=O)=CC=C1
Canonical SMILES
O=C(OC(C)C)C(=CC1=CC=CC(=C1)N(=O)=O)C(=O)C
Other Names for this Substance
- Butanoic acid, 2-[(3-nitrophenyl)methylene]-3-oxo-, 1-methylethyl ester
- 1-Methylethyl 2-[(3-nitrophenyl)methylene]-3-oxobutanoate
- Isopropyl 2-(3-nitrobenzylidene)acetoacetate
- Isopropyl 2-(m-nitrobenzylidene)acetoacetate