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CAS 13544-07-5

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Methyl 2-nitro-4-(trifluoromethyl)benzeneacetate

Description:
Methyl 2-nitro-4-(trifluoromethyl)benzeneacetate, with the CAS number 13544-07-5, is an organic compound characterized by its aromatic structure, which includes a nitro group and a trifluoromethyl group attached to a benzene ring. This compound features an ester functional group, specifically a methyl ester, which contributes to its reactivity and solubility properties. The presence of the nitro group typically imparts electron-withdrawing characteristics, influencing the compound's reactivity in electrophilic aromatic substitution reactions. The trifluoromethyl group enhances the compound's lipophilicity and can affect its biological activity. Methyl 2-nitro-4-(trifluoromethyl)benzeneacetate is often utilized in synthetic organic chemistry as an intermediate for the preparation of various pharmaceuticals and agrochemicals. Its physical properties, such as boiling point, melting point, and solubility, can vary based on environmental conditions and the presence of other solvents. Safety precautions should be observed when handling this compound, as it may pose health risks due to its chemical nature.
Formula:C10H8F3NO4
InChI:InChI=1S/C10H8F3NO4/c1-18-9(15)4-6-2-3-7(10(11,12)13)5-8(6)14(16)17/h2-3,5H,4H2,1H3
InChI key:InChIKey=WFQOIJIXNFOYCM-UHFFFAOYSA-N
SMILES:N(=O)(=O)C1=C(CC(OC)=O)C=CC(C(F)(F)F)=C1
Synonyms:
  • (2-Nitro-4-trifluoromethylphenyl)acetic acid methyl ester
  • Acetic acid, (α,α,α-trifluoro-2-nitro-p-tolyl)-, methyl ester
  • Benzeneacetic acid, 2-nitro-4-(trifluoromethyl)-, methyl ester
  • Methyl 2-[2-nitro-4-(trifluoromethyl)phenyl]acetate
  • Methyl 2-nitro-4-(trifluoromethyl)benzeneacetate
  • Methyl 2-nitro-4-(trifluoromethyl)phenylacetate
  • Methyl [2-Nitro-4-(Trifluoromethyl)Phenyl]Acetate
  • Methyl (2-nitro-4-trifluorobenzyl)acetate
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