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CAS 100596-39-2

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1,3-Dimethyl 5-[4-(methoxycarbonyl)-2-nitrophenoxy]-1,3-benzenedicarboxylate

Description:
1,3-Dimethyl 5-[4-(methoxycarbonyl)-2-nitrophenoxy]-1,3-benzenedicarboxylate, with CAS number 100596-39-2, is an organic compound characterized by its complex structure, which includes multiple functional groups. It features two carboxylate ester groups, which contribute to its solubility in organic solvents and potential reactivity in various chemical reactions. The presence of a nitro group and a methoxycarbonyl group indicates that it may exhibit interesting electronic properties and reactivity, making it a candidate for applications in organic synthesis and potentially in pharmaceuticals. The compound's aromatic rings suggest stability and the possibility of undergoing electrophilic substitution reactions. Additionally, the dimethyl substituents may influence its steric properties and overall reactivity. Overall, this compound's unique combination of functional groups and structural features makes it a subject of interest in both synthetic organic chemistry and materials science.
Formula:C18H15NO9
InChI:InChI=1S/C18H15NO9/c1-25-16(20)10-4-5-15(14(9-10)19(23)24)28-13-7-11(17(21)26-2)6-12(8-13)18(22)27-3/h4-9H,1-3H3
InChI key:InChIKey=NZUIFJUDFWPJPN-UHFFFAOYSA-N
SMILES:O(C1=C(N(=O)=O)C=C(C(OC)=O)C=C1)C2=CC(C(OC)=O)=CC(C(OC)=O)=C2
Synonyms:
  • 1,3-Dimethyl 5-[4-(methoxycarbonyl)-2-nitrophenoxy]-1,3-benzenedicarboxylate
  • 1,3-Benzenedicarboxylic acid, 5-[4-(methoxycarbonyl)-2-nitrophenoxy]-, 1,3-dimethyl ester
  • 1,3-Benzenedicarboxylic acid, 5-[4-(methoxycarbonyl)-2-nitrophenoxy]-, dimethyl ester
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