3-(2-Ethylphenyl)-5-(3-methoxyphenyl)-1H-1,2,4-triazole
[CAS# 69095-83-6]

Identification

• Name: 3-(2-Ethylphenyl)-5-(3-methoxyphenyl)-1H-1,2,4-triazole
• Synonyms: Contragestazol; St-1959; (3-Ethylphenyl)-5-(3-Methoxyphenyl)-1,2,4-Triazole
• Molecular Formula: C₁₇H₁₇N₃O
• Molecular Weight: 279.34
• CAS Registry Number: 69095-83-6
• SMILES: C1=C(OC)C=CC=C1C2=N[NH]C(=N2)C3=C(C=CC=C3)CC
• InChI: 1S/C17H17N3O/c1-3-12-7-4-5-10-15(12)17-18-16(19-20-17)13-8-6-9-14(11-13)21-2/h4-11H,3H2,1-2H3,(H,18,19,20)
• InChIKey: GXCZZAKPGMYPDJ-UHFFFAOYSA-N

Properties

• Density: 1.156g/cm³ (Cal.)
• Boiling point: 501.338°C at 760 mmHg (Cal.)
• Flash point: 177.905°C (Cal.)