1-(1,3-Benzothiazol-2-Yl)-3-Buten-2-One
[CAS# 215503-85-8]

Identification

• Name: 1-(1,3-Benzothiazol-2-Yl)-3-Buten-2-One
• Synonyms: 1-(benzo[d]thiazol-2-yl)but-3-en-2-one
• Molecular Formula: C₁₁H₉NOS
• Molecular Weight: 203.26
• CAS Registry Number: 215503-85-8
• SMILES: C=CC(=O)Cc1nc2ccccc2s1
• InChI: 1S/C11H9NOS/c1-2-8(13)7-11-12-9-5-3-4-6-10(9)14-11/h2-6H,1,7H2
• InChIKey: QRMUPQWCKWUIMI-UHFFFAOYSA-N

Properties

• Density: 1.237g/cm³ (Cal.)
• Boiling point: 332.629°C at 760 mmHg (Cal.)
• Flash point: 154.969°C (Cal.)
• Refractive index: 1.639 (Cal.)