4-(4-{[3-(2,6-Dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}-1-piperazinyl)benzonitrile
[CAS# 883042-07-7]

Identification

• Name: 4-(4-{[3-(2,6-Dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}-1-piperazinyl)benzonitrile
• Synonyms: Benzonitrile, 4-[4-[[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]carbonyl]-1-piperazinyl]-; Benzonitrile,4-[4-[[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]carbonyl]-1-piperazinyl]-
• Molecular Formula: C₂₂H₁₈Cl₂N₄O₂
• Molecular Weight: 441.31
• CAS Registry Number: 883042-07-7
• SMILES: N#Cc1ccc(cc1)N4CCN(C(=O)c3c(onc3c2c(Cl)cccc2Cl)C)CC4
• InChI: 1S/C22H18Cl2N4O2/c1-14-19(21(26-30-14)20-17(23)3-2-4-18(20)24)22(29)28-11-9-27(10-12-28)16-7-5-15(13-25)6-8-16/h2-8H,9-12H2,1H3
• InChIKey: GODHMDQTUWRHAD-UHFFFAOYSA-N

Properties

• Density: 1.451g/cm³ (Cal.)
• Boiling point: 663.79°C at 760 mmHg (Cal.)
• Flash point: 355.248°C (Cal.)
• Refractive index: 1.675 (Cal.)