2-Ethylsulfonyl-1,3-Benzothiazole
[CAS# 2591-11-9]

Identification

• Name: 2-Ethylsulfonyl-1,3-Benzothiazole
• Synonyms: Benzothiazole, Ethylsulfonyl-; Ethyl 2-Benzothiazyl Sulfone; Ethylsulfonylbenzothiazole
• Molecular Formula: C₉H₉NO₂S₂
• Molecular Weight: 227.30
• CAS Registry Number: 2591-11-9
• SMILES: C2=C1SC(=NC1=CC=C2)[S](=O)(=O)CC
• InChI: 1S/C9H9NO2S2/c1-2-14(11,12)9-10-7-5-3-4-6-8(7)13-9/h3-6H,2H2,1H3
• InChIKey: ZYGPCLHWVYJMPA-UHFFFAOYSA-N

Properties

• Density: 1.381g/cm³ (Cal.)
• Boiling point: 377.006°C at 760 mmHg (Cal.)
• Flash point: 181.807°C (Cal.)