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CAS 78543-06-3

:

1,3-Diethyl 2-(3-fluoro-4-nitrophenyl)-2-methylpropanedioate

Description:
1,3-Diethyl 2-(3-fluoro-4-nitrophenyl)-2-methylpropanedioate is an organic compound characterized by its complex structure, which includes a diethyl ester functional group and a substituted aromatic ring. The presence of the 3-fluoro and 4-nitro groups on the phenyl ring contributes to its electronic properties, potentially influencing its reactivity and interactions in chemical processes. This compound is likely to be a yellow to orange solid, given the nitro group’s typical coloration in organic compounds. It is soluble in organic solvents, but its solubility in water may be limited due to the hydrophobic nature of the ethyl groups and the aromatic system. The compound may exhibit moderate to high stability under standard conditions, but it could be sensitive to light or heat, which is common for nitro-substituted compounds. Its applications could range from use in organic synthesis to potential roles in pharmaceuticals or agrochemicals, depending on its biological activity and reactivity. Safety precautions should be taken when handling this compound due to the presence of potentially hazardous functional groups.
Formula:C14H16FNO6
InChI:InChI=1S/C14H16FNO6/c1-4-21-12(17)14(3,13(18)22-5-2)9-6-7-11(16(19)20)10(15)8-9/h6-8H,4-5H2,1-3H3
InChI key:InChIKey=VHMVOAWAZZEEPH-UHFFFAOYSA-N
SMILES:C(C(OCC)=O)(C(OCC)=O)(C)C1=CC(F)=C(N(=O)=O)C=C1
Synonyms:
  • 1,3-Diethyl 2-(3-fluoro-4-nitrophenyl)-2-methylpropanedioate
  • 2-(3-Fluoro-4-nitrophenyl)-2-methylmalonic acid diethyl ester
  • Diethyl 2-(3-fluoro-4-nitrophenyl)-2-methylpropanedioate
  • Diethyl-2 (3-fluoro-4-nitrophenyl)-2-methylmalonate
  • Propanedioic acid, (3-fluoro-4-nitrophenyl)methyl-, diethyl ester
  • Propanedioic acid, 2-(3-fluoro-4-nitrophenyl)-2-methyl-, 1,3-diethyl ester
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