3-(4-Bromophenyl)-5-Pentyl-1,3,4-Oxadiazol-2(3H)-One
[CAS# 28740-56-9]

Identification

• Name: 3-(4-Bromophenyl)-5-Pentyl-1,3,4-Oxadiazol-2(3H)-One
• Synonyms: 3-(4-Bromophenyl)-5-pentyl-1,3,4-oxadiazol-2(3H)-one #; δ2-1,3,4-Oxadiazolin-5-one, 4-(p-bromophenyl)-2-pentyl-
• Molecular Formula: C₁₃H₁₅BrN₂O₂
• Molecular Weight: 311.17
• CAS Registry Number: 28740-56-9
• SMILES: O=C2O\C(=N/N2c1ccc(Br)cc1)CCCCC
• InChI: 1S/C13H15BrN2O2/c1-2-3-4-5-12-15-16(13(17)18-12)11-8-6-10(14)7-9-11/h6-9H,2-5H2,1H3
• InChIKey: WJNJTNARAJURHF-UHFFFAOYSA-N

Properties

• Density: 1.441g/cm³ (Cal.)
• Boiling point: 364.968°C at 760 mmHg (Cal.)
• Flash point: 174.527°C (Cal.)
• Refractive index: 1.601 (Cal.)