1,4-Dihydro-1,2,4,5-Tetrazine-3,6-Dicarboxylic Acid
[CAS# 3787-09-5]

Identification

• Name: 1,4-Dihydro-1,2,4,5-Tetrazine-3,6-Dicarboxylic Acid
• Synonyms: Nci60_002616; Nsc139234
• Molecular Formula: C₄H₄N₄O₄
• Molecular Weight: 172.10
• CAS Registry Number: 3787-09-5
• SMILES: O=C(C1=NNC(=NN1)C(=O)O)O
• InChI: 1S/C4H4N4O4/c9-3(10)1-5-7-2(4(11)12)8-6-1/h(H,5,6)(H,7,8)(H,9,10)(H,11,12)
• InChIKey: BJEZXJBWVBDMLN-UHFFFAOYSA-N

Properties

• Density: 2.253g/cm³ (Cal.)
• Boiling point: 422.066°C at 760 mmHg (Cal.)
• Flash point: 209.058°C (Cal.)