2-Methyl-2-propanyl 4-(5-amino-6-chloro-4-pyrimidinyl)-1-piperazinecarboxylate
[CAS# 853679-43-3]

Identification

• Name: 2-Methyl-2-propanyl 4-(5-amino-6-chloro-4-pyrimidinyl)-1-piperazinecarboxylate
• Synonyms: 1-Boc-4-(5-amino-6-chloro-4-pyrimidinyl)piperazine
• Molecular Formula: C₁₃H₂₀ClN₅O₂
• Molecular Weight: 313.78
• CAS Registry Number: 853679-43-3
• SMILES: CC(C)(C)OC(=O)N1CCN(CC1)c2c(c(ncn2)Cl)N
• InChI: 1S/C13H20ClN5O2/c1-13(2,3)21-12(20)19-6-4-18(5-7-19)11-9(15)10(14)16-8-17-11/h8H,4-7,15H2,1-3H3
• InChIKey: TZKQCWFMOBLFIR-UHFFFAOYSA-N

Properties

• Density: 1.304g/cm³ (Cal.)
• Boiling point: 468.299°C at 760 mmHg (Cal.)
• Flash point: 237.019°C (Cal.)
• Refractive index: 1.581 (Cal.)