3-[(4-{3-[6-(Trifluoromethyl)-3-pyridinyl]-1,2,4-oxadiazol-5-yl}-1-piperidinyl)methyl]benzonitrile
[CAS# 909662-41-5]

Identification

• Name: 3-[(4-{3-[6-(Trifluoromethyl)-3-pyridinyl]-1,2,4-oxadiazol-5-yl}-1-piperidinyl)methyl]benzonitrile
• Synonyms: 3-[(4-{3-[6-(trifluoromethyl)pyridin-3-yl]-1,2,4-oxadiazol-5-yl}piperidin-1-yl)methyl]benzonitrile
• Molecular Formula: C₂₁H₁₈F₃N₅O
• Molecular Weight: 413.40
• CAS Registry Number: 909662-41-5
• SMILES: N#Cc1cccc(c1)CN2CCC(CC2)c3nc(no3)c4cnc(cc4)C(F)(F)F
• InChI: 1S/C21H18F3N5O/c22-21(23,24)18-5-4-17(12-26-18)19-27-20(30-28-19)16-6-8-29(9-7-16)13-15-3-1-2-14(10-15)11-25/h1-5,10,12,16H,6-9,13H2
• InChIKey: QYCPHKGPNGFPQA-UHFFFAOYSA-N

Properties

• Density: 1.392g/cm³ (Cal.)
• Boiling point: 532.585°C at 760 mmHg (Cal.)
• Flash point: 275.898°C (Cal.)
• Refractive index: 1.597 (Cal.)