9-Ethylsulfanyl-4-Propan-2-Yl-4,8,10-Triazabicyclo[4.4.0]Deca-8,11-Dien-7-One
[CAS# 15637-62-4]

Identification

• Name: 9-Ethylsulfanyl-4-Propan-2-Yl-4,8,10-Triazabicyclo[4.4.0]Deca-8,11-Dien-7-One
• Synonyms: 2-Ethylsulfanyl-6-Isopropyl-1,5,7,8-Tetrahydropyrido[3,4-E]Pyrimidin-4-One; 2-(Ethylthio)-6-Isopropyl-1,5,7,8-Tetrahydropyrido[3,4-E]Pyrimidin-4-One; Nsc525972
• Molecular Formula: C₁₂H₁₉N₃OS
• Molecular Weight: 253.36
• CAS Registry Number: 15637-62-4
• SMILES: C(C)SC1=NC(=O)C2=C(N1)CCN(C(C)C)C2
• InChI: 1S/C12H19N3OS/c1-4-17-12-13-10-5-6-15(8(2)3)7-9(10)11(16)14-12/h8H,4-7H2,1-3H3,(H,13,14,16)
• InChIKey: HRXDDRRTCRVDFY-UHFFFAOYSA-N

Properties

• Density: 1.278g/cm³ (Cal.)
• Boiling point: 389.387°C at 760 mmHg (Cal.)
• Flash point: 189.295°C (Cal.)