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CAS 753924-48-0

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Benzoic acid, 2-fluoro-4-methyl-5-nitro-, methyl ester

Description:
Benzoic acid, 2-fluoro-4-methyl-5-nitro-, methyl ester, with the CAS number 753924-48-0, is an organic compound characterized by its aromatic structure, which includes a benzoic acid moiety modified by the presence of a fluoro group, a methyl group, and a nitro group. This compound typically exhibits properties associated with both aromatic compounds and esters, such as moderate solubility in organic solvents and potential reactivity due to the presence of the nitro group, which can participate in electrophilic substitution reactions. The fluoro substituent can influence the compound's polarity and reactivity, while the methyl ester functional group may enhance its lipophilicity. Additionally, the presence of the nitro group can impart unique electronic properties, making this compound of interest in various chemical applications, including pharmaceuticals and agrochemicals. Its synthesis and handling require standard laboratory safety protocols due to the potential hazards associated with its reactive functional groups.
Formula:C9H8FNO4
InChI:InChI=1S/C9H8FNO4/c1-5-3-7(10)6(9(12)15-2)4-8(5)11(13)14/h3-4H,1-2H3
InChI key:InChIKey=GBECACDDVVYBHV-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=CC(N(=O)=O)=C(C)C=C1F
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