3,6-Bis(2-chlorophenyl)-1,2-dihydro-1,2,4,5-tetrazine
[CAS# 74115-15-4]

Identification

• Name: 3,6-Bis(2-chlorophenyl)-1,2-dihydro-1,2,4,5-tetrazine
• Synonyms: 3,6-BIS(2-CHLOROPHENYL)-1,2-DIHYDRO-1,2,4,5-TETRAZINE
• Molecular Formula: C₁₄H₁₀Cl₂N₄
• Molecular Weight: 305.16
• CAS Registry Number: 74115-15-4
• SMILES: Clc3ccccc3C=1NN/C(=N\N=1)c2ccccc2Cl
• InChI: 1S/C14H10Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H,(H,17,18)(H,19,20)
• InChIKey: DMOSPPXFAKVBOQ-UHFFFAOYSA-N

Properties

• Density: 1.454g/cm³ (Cal.)
• Boiling point: 426.586°C at 760 mmHg (Cal.)
• Flash point: 211.792°C (Cal.)

References

• (1): J. Zachara, I. Madura and M. Wlostowski. Hydrogen-bonding patterns in two structural isomers of 3,6-bis(2-chlorophenyl)-1,4-dihydro-1,2,4,5-tetrazine, Acta Cryst. (2004). C60, o57-o59