1,2,4-Triazole-3,4-Diamine
[CAS# 38104-45-9]

Identification

• Name: 1,2,4-Triazole-3,4-Diamine
• Synonyms: (3-Amino-1,2,4-Triazol-4-Yl)Amine; Zinc04152201; 3,4-Diamino-1,2,4(4H)-Triazole
• Molecular Formula: C₂H₅N₅
• Molecular Weight: 99.10
• CAS Registry Number: 38104-45-9
• SMILES: C1=NN=C([N]1N)N
• InChI: 1S/C2H5N5/c3-2-6-5-1-7(2)4/h1H,4H2,(H2,3,6)
• InChIKey: VVICLQXCPOEFTM-UHFFFAOYSA-N

Properties

• Density: 2.001g/cm³ (Cal.)
• Boiling point: 388.479°C at 760 mmHg (Cal.)
• Flash point: 188.746°C (Cal.)

References

• (1): Irina S. Konovalova, Svitlana V. Shishkina, Boris V. Paponov and Oleg V. Shishkin. Analysis of the crystal structure of two polymorphic modifications of 3,4-diamino-1,2,4-triazole based on the energy of the intermolecular interactions, CrystEngComm, 2010, 12, 909.