2-(2-Methylsulfanylethyl)-1,1-Dioxo-1,2-Benzothiazol-3-One
[CAS# 125698-32-0]

Identification

• Name: 2-(2-Methylsulfanylethyl)-1,1-Dioxo-1,2-Benzothiazol-3-One
• Synonyms: 2-[2-(Methylthio)Ethyl]-1,1-Dioxo-1,2-Benzothiazol-3-One; 1,1-Diketo-2-[2-(Methylthio)Ethyl]-1,2-Benzothiazol-3-One; Zinc06019720
• Molecular Formula: C₁₀H₁₁NO₃S₂
• Molecular Weight: 257.32
• CAS Registry Number: 125698-32-0
• SMILES: C2=C1[S](=O)(N(C(=O)C1=CC=C2)CCSC)=O
• InChI: 1S/C10H11NO3S2/c1-15-7-6-11-10(12)8-4-2-3-5-9(8)16(11,13)14/h2-5H,6-7H2,1H3
• InChIKey: PCOYTLGIKATEHT-UHFFFAOYSA-N

Properties

• Density: 1.424g/cm³ (Cal.)
• Boiling point: 445.912°C at 760 mmHg (Cal.)
• Flash point: 223.48°C (Cal.)