2-Methyl-2-Propanyl 4-(6-Chloro-5-Nitro-4-Pyrimidinyl)-1-Piperazinecarboxylate
[CAS# 147539-23-9]

Identification

• Name: 2-Methyl-2-Propanyl 4-(6-Chloro-5-Nitro-4-Pyrimidinyl)-1-Piperazinecarboxylate
• Synonyms: 1-Boc-4-(6-Chloro-5-nitro-4-pyrimidinyl)piperazine; MFCD11040204; tert-Butyl 4-(6-chloro-5-nitro-pyrimidin-4-yl)piperazine-1-carboxylate
• Molecular Formula: C₁₃H₁₈ClN₅O₄
• Molecular Weight: 343.77
• CAS Registry Number: 147539-23-9
• SMILES: [O-][N+](=O)c1c(ncnc1Cl)N2CCN(CC2)C(=O)OC(C)(C)C
• InChI: 1S/C13H18ClN5O4/c1-13(2,3)23-12(20)18-6-4-17(5-7-18)11-9(19(21)22)10(14)15-8-16-11/h8H,4-7H2,1-3H3
• InChIKey: SIEVKGIBOLXNCK-UHFFFAOYSA-N

Properties

• Density: 1.374g/cm³ (Cal.)
• Boiling point: 501.507°C at 760 mmHg (Cal.)
• Flash point: 257.103°C (Cal.)
• Refractive index: 1.573 (Cal.)

Safety Data

• Safety Description: IRRITANT