(1E)-1-(1,3-Benzothiazol-2(3H)-Ylidene)-2-Butanethione
[CAS# 4435-45-4]

Identification

• Name: (1E)-1-(1,3-Benzothiazol-2(3H)-Ylidene)-2-Butanethione
• Synonyms: (E)-1-(benzo[d]thiazol-2(3H)-ylidene)butane-2-thione
• Molecular Formula: C₁₁H₁₁NS₂
• Molecular Weight: 221.34
• CAS Registry Number: 4435-45-4
• SMILES: CCC(=S)/C=C/1\Nc2ccccc2S1
• InChI: 1S/C11H11NS2/c1-2-8(13)7-11-12-9-5-3-4-6-10(9)14-11/h3-7,12H,2H2,1H3/b11-7+
• InChIKey: WBXKVBPFHAQOEM-YRNVUSSQSA-N

Properties

• Density: 1.308g/cm³ (Cal.)
• Boiling point: 311.185°C at 760 mmHg (Cal.)
• Flash point: 142°C (Cal.)