1-(1,3-Benzothiazol-2-Yl)-1-Pentanone
[CAS# 41881-86-1]

Identification

• Name: 1-(1,3-Benzothiazol-2-Yl)-1-Pentanone
• Synonyms: 1-(benzo[d]thiazol-2-yl)pentan-1-one; 1-Pentanone,1-(2-benzothiazolyl)-
• Molecular Formula: C₁₂H₁₃NOS
• Molecular Weight: 219.30
• CAS Registry Number: 41881-86-1
• SMILES: CCCCC(=O)c1nc2ccccc2s1
• InChI: 1S/C12H13NOS/c1-2-3-7-10(14)12-13-9-6-4-5-8-11(9)15-12/h4-6,8H,2-3,7H2,1H3
• InChIKey: XEXFPKOLNNCDCV-UHFFFAOYSA-N

Properties

• Density: 1.171g/cm³ (Cal.)
• Boiling point: 340.039°C at 760 mmHg (Cal.)
• Flash point: 159.45°C (Cal.)