3-(2,5-Dimethoxyphenyl)-6-Thia-1,4-Diazabicyclo[3.3.0]Octa-2,4-Diene
[CAS# 100849-95-4]

Identification

• Name: 3-(2,5-Dimethoxyphenyl)-6-Thia-1,4-Diazabicyclo[3.3.0]Octa-2,4-Diene
• Synonyms: 6-(2,5-Dimethoxyphenyl)-2,3-Dihydroimidazo[2,1-B]Thiazole; 2,3-Dihydro-6-(2,5-Dimethoxyphenyl)Imidazo(2,1-B)Thiazole; Imidazo(2,1-B)Thiazole, 6-(2,5-Dimethoxyphenyl)-2,3-Dihydro-
• Molecular Formula: C₁₃H₁₄N₂O₂S
• Molecular Weight: 262.33
• CAS Registry Number: 100849-95-4
• SMILES: C1=CC(=C(C=C1OC)C2=C[N]3C(=N2)SCC3)OC
• InChI: 1S/C13H14N2O2S/c1-16-9-3-4-12(17-2)10(7-9)11-8-15-5-6-18-13(15)14-11/h3-4,7-8H,5-6H2,1-2H3
• InChIKey: OUUQZRGCJFTFEN-UHFFFAOYSA-N

Properties

• Density: 1.327g/cm³ (Cal.)
• Boiling point: 441.492°C at 760 mmHg (Cal.)
• Flash point: 220.806°C (Cal.)