4-(1,3-Benzothiazol-2-Ylamino)-2-Butanone
[CAS# 21018-43-9]

Identification

• Name: 4-(1,3-Benzothiazol-2-Ylamino)-2-Butanone
• Synonyms: 4-(benzo[d]thiazol-2-ylamino)butan-2-one
• Molecular Formula: C₁₁H₁₂N₂OS
• Molecular Weight: 220.29
• CAS Registry Number: 21018-43-9
• SMILES: CC(=O)CCNc1nc2ccccc2s1
• InChI: 1S/C11H12N2OS/c1-8(14)6-7-12-11-13-9-4-2-3-5-10(9)15-11/h2-5H,6-7H2,1H3,(H,12,13)
• InChIKey: CNMUFMCHLDCOAK-UHFFFAOYSA-N

Properties

• Density: 1.278g/cm³ (Cal.)
• Boiling point: 368.981°C at 760 mmHg (Cal.)
• Flash point: 176.954°C (Cal.)
• Refractive index: 1.666 (Cal.)