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CAS 113772-13-7

:

methyl 2-cyano-2-(2-nitrophenyl)acetate

Description:
Methyl 2-cyano-2-(2-nitrophenyl)acetate, with the CAS number 113772-13-7, is an organic compound characterized by its functional groups, including a cyano group and an ester group. It typically appears as a yellow to orange crystalline solid or liquid, depending on its purity and specific conditions. The presence of the nitrophenyl moiety contributes to its potential as a chromophore, which may impart distinct optical properties. This compound is often utilized in organic synthesis and may serve as an intermediate in the production of various pharmaceuticals and agrochemicals. Its reactivity is influenced by the electron-withdrawing nature of the cyano and nitro groups, making it a suitable candidate for nucleophilic substitution reactions. Additionally, the compound may exhibit moderate to high toxicity, necessitating careful handling and appropriate safety measures during its use in laboratory or industrial settings. As with many organic compounds, its solubility and stability can vary based on environmental conditions such as temperature and pH.
Formula:C10H8N2O4
InChI:InChI=1/C10H8N2O4/c1-16-10(13)8(6-11)7-4-2-3-5-9(7)12(14)15/h2-5,8H,1H3
SMILES:COC(=O)C(C#N)c1ccccc1N(=O)=O
Synonyms:
  • Methyl Cyano(2-Nitrophenyl)Acetate
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