5,6-Dimethoxy-1,3-Benzothiazole-2-Carbonitrile
[CAS# 101858-00-8]

Identification

• Name: 5,6-Dimethoxy-1,3-Benzothiazole-2-Carbonitrile
• Synonyms: 5,6-dimethoxybenzo[d]thiazole-2-carbonitrile
• Molecular Formula: C₁₀H₈N₂O₂S
• Molecular Weight: 220.25
• CAS Registry Number: 101858-00-8
• SMILES: COc1cc2nc(C#N)sc2cc1OC
• InChI: 1S/C10H8N2O2S/c1-13-7-3-6-9(4-8(7)14-2)15-10(5-11)12-6/h3-4H,1-2H3
• InChIKey: YGQPKDRNTSMOAW-UHFFFAOYSA-N

Properties

• Density: 1.361g/cm³ (Cal.)
• Boiling point: 356.166°C at 760 mmHg (Cal.)
• Flash point: 169.203°C (Cal.)
• Refractive index: 1.629 (Cal.)