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CAS 59382-60-4

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Ethyl 2-methyl-3-nitrobenzoate

Description:
Ethyl 2-methyl-3-nitrobenzoate, with the CAS number 59382-60-4, is an organic compound belonging to the class of nitrobenzoates. It features a benzoate structure with a nitro group and an ethyl ester functional group. This compound typically appears as a yellow to light brown solid or liquid, depending on its purity and specific conditions. It is characterized by its aromatic nature, which contributes to its stability and reactivity. Ethyl 2-methyl-3-nitrobenzoate is known for its applications in organic synthesis, particularly as an intermediate in the production of various pharmaceuticals and agrochemicals. The presence of the nitro group enhances its electrophilic properties, making it useful in further chemical transformations. Additionally, it may exhibit moderate solubility in organic solvents, while being less soluble in water. Safety precautions should be observed when handling this compound, as nitro compounds can be hazardous and may pose environmental risks. Overall, its unique structure and properties make it a valuable compound in chemical research and industrial applications.
Formula:C10H11NO4
InChI:InChI=1S/C10H11NO4/c1-3-15-10(12)8-5-4-6-9(7(8)2)11(13)14/h4-6H,3H2,1-2H3
InChI key:InChIKey=XINYBVBBEWUEPZ-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C1=C(C)C(N(=O)=O)=CC=C1
Synonyms:
  • 2-Methyl-3-nitro-benzoic acid ethyl ester
  • Benzoic acid, 2-methyl-3-nitro-, ethyl ester
  • o-Toluic acid, 3-nitro-, ethyl ester
  • Ethyl 2-methyl-3-nitrobenzoate
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