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CAS 2166-14-5

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Dimethyl 1,2,4,5-tetrazine-3,6-dicarboxylate

Description:
Dimethyl 1,2,4,5-tetrazine-3,6-dicarboxylate is a chemical compound characterized by its tetrazine ring structure, which is a five-membered heterocyclic compound containing four nitrogen atoms and one carbon atom. This compound features two carboxylate ester groups, which contribute to its solubility and reactivity. It is typically a crystalline solid at room temperature and is known for its potential applications in organic synthesis and as a building block in the development of energetic materials. The presence of the dimethyl ester groups enhances its reactivity and solubility in organic solvents. Dimethyl 1,2,4,5-tetrazine-3,6-dicarboxylate can undergo various chemical reactions, including hydrolysis and condensation, making it a versatile intermediate in synthetic chemistry. Additionally, due to the presence of multiple nitrogen atoms, it may exhibit interesting properties related to energy release and stability, which are of interest in materials science and pyrotechnics. Safety precautions should be taken when handling this compound, as with many nitrogen-rich compounds, due to potential hazards associated with its reactivity.
Formula:C6H6N4O4
InChI:InChI=1S/C6H6N4O4/c1-13-5(11)3-7-9-4(10-8-3)6(12)14-2/h1-2H3
InChI key:InChIKey=QODPSGGFQFBWME-UHFFFAOYSA-N
SMILES:C(OC)(=O)C=1N=NC(C(OC)=O)=NN1
Synonyms:
  • s-Tetrazine-3,6-dicarboxylic acid, dimethyl ester
  • Dimethyl 1,2,4,5-tetrazine-3,6-dicarboxylate
  • 1,2,4,5-Tetrazine-3,6-dicarboxylic acid, dimethyl ester
  • 1,2,4,5-Tetrazine-3,6-dicarboxylic acid, 3,6-dimethyl ester
  • 3,6-Bis(methoxycarbonyl)tetrazine
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