(1E)-1-(1,3-Benzothiazol-2(3H)-Ylidene)-2-Butanone
[CAS# 6783-99-9]

Identification

• Name: (1E)-1-(1,3-Benzothiazol-2(3H)-Ylidene)-2-Butanone
• Synonyms: (E)-1-(benzo[d]thiazol-2(3H)-ylidene)butan-2-one
• Molecular Formula: C₁₁H₁₁NOS
• Molecular Weight: 205.28
• CAS Registry Number: 6783-99-9
• SMILES: CCC(=O)/C=C/1\Nc2ccccc2S1
• InChI: 1S/C11H11NOS/c1-2-8(13)7-11-12-9-5-3-4-6-10(9)14-11/h3-7,12H,2H2,1H3/b11-7+
• InChIKey: QLBATEAZKMJSML-YRNVUSSQSA-N

Properties

• Density: 1.272g/cm³ (Cal.)
• Boiling point: 332.618°C at 760 mmHg (Cal.)
• Flash point: 154.962°C (Cal.)