9-(2-Methyl-2-Propanyl)Pyrimido[2,1-c][1,2,4]Triazepine-7(1H)-Thione
[CAS# 135200-83-8]

Identification

• Name: 9-(2-Methyl-2-Propanyl)Pyrimido[2,1-c][1,2,4]Triazepine-7(1H)-Thione
• Synonyms: 9-(tert-butyl)pyrimido[2,1-c][1,2,4]triazepine-7(1H)-thione
• Molecular Formula: C₁₁H₁₄N₄S
• Molecular Weight: 234.32
• CAS Registry Number: 135200-83-8
• SMILES: CC(C)(C)c1cc(=S)n2c(n1)NN=CC=C2
• InChI: 1S/C11H14N4S/c1-11(2,3)8-7-9(16)15-6-4-5-12-14-10(15)13-8/h4-7H,1-3H3,(H,13,14)
• InChIKey: HTWPSCIWQVRESE-UHFFFAOYSA-N

Properties

• Density: 1.239g/cm³ (Cal.)
• Boiling point: 340.534°C at 760 mmHg (Cal.)
• Flash point: 159.75°C (Cal.)
• Refractive index: 1.645 (Cal.)