cis-1-((2-(2-Benzofuranyl)-4-Ethyl-1,3-Dioxolan-2-Yl)Methyl)-1H-1,2,4-Triazole
[CAS# 98518-99-1]

Identification

• Name: cis-1-((2-(2-Benzofuranyl)-4-Ethyl-1,3-Dioxolan-2-Yl)Methyl)-1H-1,2,4-Triazole
• Synonyms: 1-[[(2R,4R)-2-(Benzofuran-2-Yl)-4-Ethyl-1,3-Dioxolan-2-Yl]Methyl]-1,2,4-Triazole; 1-[[(2R,4R)-2-(2-Benzofuranyl)-4-Ethyl-1,3-Dioxolan-2-Yl]Methyl]-1,2,4-Triazole; 1H-1,2,4-Triazole, 1-((2-(2-Benzofuranyl)-4-Ethyl-1,3-Dioxolan-2-Yl)Methyl)-, Cis-
• Molecular Formula: C₁₆H₁₇N₃O₃
• Molecular Weight: 299.33
• CAS Registry Number: 98518-99-1
• SMILES: [C@]1(O[C@@H](CO1)CC)(C3=CC2=CC=CC=C2O3)C[N]4N=CN=C4
• InChI: 1S/C16H17N3O3/c1-2-13-8-20-16(22-13,9-19-11-17-10-18-19)15-7-12-5-3-4-6-14(12)21-15/h3-7,10-11,13H,2,8-9H2,1H3/t13-,16-/m1/s1
• InChIKey: NDNRJWWYXRNCTI-CZUORRHYSA-N

Properties

• Density: 1.359g/cm³ (Cal.)
• Boiling point: 474.299°C at 760 mmHg (Cal.)
• Flash point: 240.648°C (Cal.)