5-Amino-1,3-Benzothiazole-2(3H)-Thione
[CAS# 52386-09-1]

Identification

• Name: 5-Amino-1,3-Benzothiazole-2(3H)-Thione
• Synonyms: 2(3H)-Benzothiazolethione,5-amino-; 5-aminobenzo[d]thiazole-2(3H)-thione
• Molecular Formula: C₇H₆N₂S₂
• Molecular Weight: 182.27
• CAS Registry Number: 52386-09-1
• SMILES: S=C2Sc1ccc(cc1N2)N
• InChI: 1S/C7H6N2S2/c8-4-1-2-6-5(3-4)9-7(10)11-6/h1-3H,8H2,(H,9,10)
• InChIKey: CDQBEUOQQTTZQR-UHFFFAOYSA-N

Properties

• Density: 1.549g/cm³ (Cal.)
• Boiling point: 390.178°C at 760 mmHg (Cal.)
• Flash point: 189.773°C (Cal.)

References

• (1): H.-P. Zhong, L.-S. Long, R.-B. Huang, L.-S. Zheng and S. W. Ng. 5-Amino-1,3-benzothiazole-2(3H)-thione, Acta Cryst. (2003). E59, o1599-o1600