5-(1,3-Benzodioxol-5-Yl)-N-Phenyl-1,3,4-Thiadiazol-2-Amine
[CAS# 83796-18-3]

Identification

• Name: 5-(1,3-Benzodioxol-5-Yl)-N-Phenyl-1,3,4-Thiadiazol-2-Amine
• Synonyms: [5-(1,3-Benzodioxol-5-Yl)-1,3,4-Thiadiazol-2-Yl]-Phenyl-Amine; 1,3,4-Thiadiazol-2-Amine, 5-(1,3-Benzodioxol-5-Yl)-N-Phenyl-; 2-(1,3-Benzodioxol-5-Yl)-2-Phenylamino-1,3,4-Thiadiazole
• Molecular Formula: C₁₅H₁₁N₃O₂S
• Molecular Weight: 297.33
• CAS Registry Number: 83796-18-3
• SMILES: C1=CC=CC=C1NC2=NN=C(S2)C4=CC=C3OCOC3=C4
• InChI: 1S/C15H11N3O2S/c1-2-4-11(5-3-1)16-15-18-17-14(21-15)10-6-7-12-13(8-10)20-9-19-12/h1-8H,9H2,(H,16,18)
• InChIKey: NIRXRSLSDTWCDS-UHFFFAOYSA-N

Properties

• Density: 1.43g/cm³ (Cal.)
• Boiling point: 473.621°C at 760 mmHg (Cal.)
• Flash point: 240.237°C (Cal.)