N-Acetylethionine Sulfoxide
[CAS# 26108-79-2]

Identification

• Name: N-Acetylethionine Sulfoxide
• Synonyms: 2-Acetamido-4-Ethylsulfinyl-Butanoic Acid; 2-Acetamido-4-Ethylsulfinyl-Butyric Acid; Butanoic Acid, 2-(Acetylamino)-4-(Ethylsulfinyl)-
• Molecular Formula: C₈H₁₅NO₄S
• Molecular Weight: 221.27
• CAS Registry Number: 26108-79-2
• SMILES: C(C(C(=O)O)NC(=O)C)C[S](=O)CC
• InChI: 1S/C8H15NO4S/c1-3-14(13)5-4-7(8(11)12)9-6(2)10/h7H,3-5H2,1-2H3,(H,9,10)(H,11,12)
• InChIKey: UIMDSSJRTSCQDK-UHFFFAOYSA-N

Properties

• Density: 1.294g/cm³ (Cal.)
• Boiling point: 577.194°C at 760 mmHg (Cal.)
• Flash point: 302.876°C (Cal.)