4-[6-Chloro-2-(Methylamino)-5-(Methylthio)-4-Pyrimidinyl]-1-Piperazineethanol
[CAS# 55477-27-5]

Identification

• Name: 4-[6-Chloro-2-(Methylamino)-5-(Methylthio)-4-Pyrimidinyl]-1-Piperazineethanol
• Synonyms: 2-[4-(6-Chloro-2-Methylamino-5-Methylsulfanyl-Pyrimidin-4-Yl)Piperazin-1-Yl]Ethanol; 2-[4-[6-Chloro-2-Methylamino-5-(Methylthio)-4-Pyrimidinyl]-1-Piperazinyl]Ethanol; 2-[4-[6-Chloro-2-Methylamino-5-(Methylthio)Pyrimidin-4-Yl]Piperazin-1-Yl]Ethanol
• Molecular Formula: C₁₂H₂₀ClN₅OS
• Molecular Weight: 317.84
• CAS Registry Number: 55477-27-5
• SMILES: C(N2CCN(C1=NC(=NC(=C1SC)Cl)NC)CC2)CO
• InChI: 1S/C12H20ClN5OS/c1-14-12-15-10(13)9(20-2)11(16-12)18-5-3-17(4-6-18)7-8-19/h19H,3-8H2,1-2H3,(H,14,15,16)
• InChIKey: RGXCCTUBFMDKJO-UHFFFAOYSA-N

Properties

• Density: 1.378g/cm³ (Cal.)
• Boiling point: 514.64°C at 760 mmHg (Cal.)
• Flash point: 265.045°C (Cal.)