5-(1,3-Benzodioxol-5-Yl)-3-[(Phenylamino)Methyl]-1,3,4-Oxadiazol-2-One
[CAS# 73484-47-6]

Identification

• Name: 5-(1,3-Benzodioxol-5-Yl)-3-[(Phenylamino)Methyl]-1,3,4-Oxadiazol-2-One
• Synonyms: 5-(1,3-Benzodioxol-5-Yl)-3-((Phenylamino)Methyl)-1,3,4-Oxadiazol-2(3H)-One; 1,3,4-Oxadiazol-2(3H)-One, 5-(1,3-Benzodioxol-5-Yl)-3-((Phenylamino)Methyl)-
• Molecular Formula: C₁₆H₁₃N₃O₄
• Molecular Weight: 311.30
• CAS Registry Number: 73484-47-6
• SMILES: C1=CC=CC=C1NCN2C(OC(=N2)C4=CC=C3OCOC3=C4)=O
• InChI: 1S/C16H13N3O4/c20-16-19(9-17-12-4-2-1-3-5-12)18-15(23-16)11-6-7-13-14(8-11)22-10-21-13/h1-8,17H,9-10H2
• InChIKey: CYORWRAZWKGSRK-UHFFFAOYSA-N

Properties

• Density: 1.461g/cm³ (Cal.)
• Boiling point: 477.05°C at 760 mmHg (Cal.)
• Flash point: 242.312°C (Cal.)