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CAS 1306763-54-1

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Methyl 3-cyano-5-(trifluoromethoxy)benzoate

Description:
Methyl 3-cyano-5-(trifluoromethoxy)benzoate is an organic compound characterized by its complex structure, which includes a benzoate moiety with a cyano group and a trifluoromethoxy substituent. This compound typically exhibits a polar nature due to the presence of the cyano and trifluoromethoxy groups, which can influence its solubility in various solvents. The trifluoromethoxy group imparts unique electronic properties, making the compound potentially useful in various chemical applications, including pharmaceuticals and agrochemicals. The cyano group can participate in nucleophilic reactions, while the benzoate structure may contribute to its stability and reactivity. Additionally, this compound may exhibit specific spectral characteristics in techniques such as NMR and IR spectroscopy, allowing for its identification and analysis. Overall, Methyl 3-cyano-5-(trifluoromethoxy)benzoate is a versatile compound with potential applications in synthetic chemistry and material science.
Formula:C10H6F3NO3
InChI:InChI=1S/C10H6F3NO3/c1-16-9(15)7-2-6(5-14)3-8(4-7)17-10(11,12)13/h2-4H,1H3
InChI key:InChIKey=VZIVNYYTGNAFEA-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=CC(OC(F)(F)F)=CC(C#N)=C1
Synonyms:
  • Benzoic acid, 3-cyano-5-(trifluoromethoxy)-, methyl ester
  • Methyl 3-cyano-5-(trifluoromethoxy)benzoate
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