6-(2-Sulfanylethyl)-1,3-Benzothiazole-2(3H)-Thione
[CAS# 33125-85-8]

Identification

• Name: 6-(2-Sulfanylethyl)-1,3-Benzothiazole-2(3H)-Thione
• Synonyms: 6-(2-mercaptoethyl)benzo[d]thiazole-2(3H)-thione
• Molecular Formula: C₉H₉NS₃
• Molecular Weight: 227.37
• CAS Registry Number: 33125-85-8
• SMILES: c1cc2c(cc1CCS)sc(=S)[nH]2
• InChI: 1S/C9H9NS3/c11-4-3-6-1-2-7-8(5-6)13-9(12)10-7/h1-2,5,11H,3-4H2,(H,10,12)
• InChIKey: BNBPNJMVGIKSDI-UHFFFAOYSA-N

Properties

• Density: 1.411g/cm³ (Cal.)
• Boiling point: 400.809°C at 760 mmHg (Cal.)
• Flash point: 196.203°C (Cal.)