4-Ethyl-1,3,5,6,7,8-hexahydro-2H-pyrimido[4,5-b]azepine-2-thione
[CAS# 644950-96-9]

Identification

• Name: 4-Ethyl-1,3,5,6,7,8-hexahydro-2H-pyrimido[4,5-b]azepine-2-thione
• Synonyms: 4-ethyl-5,6,7,8-tetrahydro-1H-pyrimido[4,5-b]azepine-2(3H)-thione
• Molecular Formula: C₁₀H₁₅N₃S
• Molecular Weight: 209.31
• CAS Registry Number: 644950-96-9
• SMILES: S=C2N/C/1=N/CCCCC\1=C(/N2)CC
• InChI: 1S/C10H15N3S/c1-2-8-7-5-3-4-6-11-9(7)13-10(14)12-8/h2-6H2,1H3,(H2,11,12,13,14)
• InChIKey: ZSAMXIZXKQCPHF-UHFFFAOYSA-N

Properties

• Density: 1.321g/cm³ (Cal.)
• Boiling point: 326.928°C at 760 mmHg (Cal.)
• Flash point: 151.521°C (Cal.)
• Refractive index: 1.679 (Cal.)