1-(1,3-Benzothiazol-2-yl)-3-methoxyacetone
[CAS# 99842-94-1]

Identification

• Name: 1-(1,3-Benzothiazol-2-yl)-3-methoxyacetone
• Synonyms: 1-(benzo[d]thiazol-2-yl)-3-methoxypropan-2-one
• Molecular Formula: C₁₁H₁₁NO₂S
• Molecular Weight: 221.28
• CAS Registry Number: 99842-94-1
• SMILES: COCC(=O)CC1=NC2=CC=CC=C2S1
• InChI: 1S/C11H11NO2S/c1-14-7-8(13)6-11-12-9-4-2-3-5-10(9)15-11/h2-5H,6-7H2,1H3
• InChIKey: IFJOBZHEXXZQGP-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 368.1±22.0°C at 760 mmHg (Cal.)
• Flash point: 176.4±22.3°C (Cal.)