S-[2-(1,3-Dioxoisoindol-2-Yl)Ethyl] Ethanethioate
[CAS# 1084-55-5]

Identification

• Name: S-[2-(1,3-Dioxoisoindol-2-Yl)Ethyl] Ethanethioate
• Synonyms: S-[2-(1,3-Dioxoisoindolin-2-Yl)Ethyl] Ethanethioate; Ethanethioic Acid S-[2-(1,3-Dioxo-2-Isoindolinyl)Ethyl] Ester; Ethanethioic Acid S-[2-(1,3-Diketoisoindolin-2-Yl)Ethyl] Ester
• Molecular Formula: C₁₂H₁₁NO₃S
• Molecular Weight: 249.28
• CAS Registry Number: 1084-55-5
• SMILES: C1=CC=CC2=C1C(N(C2=O)CCSC(C)=O)=O
• InChI: 1S/C12H11NO3S/c1-8(14)17-7-6-13-11(15)9-4-2-3-5-10(9)12(13)16/h2-5H,6-7H2,1H3
• InChIKey: VPXAKDDAXOLZDV-UHFFFAOYSA-N

Properties

• Density: 1.353g/cm³ (Cal.)
• Boiling point: 389.91°C at 760 mmHg (Cal.)
• Flash point: 189.611°C (Cal.)