2-(1,3-Benzothiazol-2-Yl)-3-Pentanone
[CAS# 132607-29-5]

Identification

• Name: 2-(1,3-Benzothiazol-2-Yl)-3-Pentanone
• Synonyms: 3-Pentanone,2-(2-benzothiazolyl)-
• Molecular Formula: C₁₂H₁₃NOS
• Molecular Weight: 219.30
• CAS Registry Number: 132607-29-5
• SMILES: CCC(=O)C(C)c1nc2ccccc2s1
• InChI: 1S/C12H13NOS/c1-3-10(14)8(2)12-13-9-6-4-5-7-11(9)15-12/h4-8H,3H2,1-2H3
• InChIKey: GPIBEVPMVKPRLR-UHFFFAOYSA-N

Properties

• Density: 1.176g/cm³ (Cal.)
• Boiling point: 326.673°C at 760 mmHg (Cal.)
• Flash point: 151.367°C (Cal.)
• Refractive index: 1.603 (Cal.)