2-Methyl-2-propanyl 4-{4-[(pentafluorophenoxy)carbonyl]-2-pyridinyl}-1-piperazinecarboxylate
[CAS# 944450-81-1]

Identification

• Name: 2-Methyl-2-propanyl 4-{4-[(pentafluorophenoxy)carbonyl]-2-pyridinyl}-1-piperazinecarboxylate
• Synonyms: MFCD09966147; Pentafluorophenyl 2-[4-(tert-butoxycarbonyl)piperazin-1-yl]isonicotinate; Pentafluorophenyl 2-[4-(tert-butoxycarbonyl)piperazin-1-yl]isonicotinate 90%
• Molecular Formula: C₂₁H₂₀F₅N₃O₄
• Molecular Weight: 473.39
• CAS Registry Number: 944450-81-1
• SMILES: CC(C)(C)OC(=O)N1CCN(CC1)c2cc(ccn2)C(=O)Oc3c(c(c(c(c3F)F)F)F)F
• InChI: 1S/C21H20F5N3O4/c1-21(2,3)33-20(31)29-8-6-28(7-9-29)12-10-11(4-5-27-12)19(30)32-18-16(25)14(23)13(22)15(24)17(18)26/h4-5,10H,6-9H2,1-3H3
• InChIKey: XHATYMDMSNXMKQ-UHFFFAOYSA-N

Properties

• Density: 1.402g/cm³ (Cal.)
• Boiling point: 582.984°C at 760 mmHg (Cal.)
• Flash point: 306.378°C (Cal.)
• Refractive index: 1.531 (Cal.)

Safety Data

• Safety Description: Harmful