2-Acetamido-4-Methylsulfinylbutanoic Acid
[CAS# 3054-51-1]

Identification

• Name: 2-Acetamido-4-Methylsulfinylbutanoic Acid
• Synonyms: 2-Acetamido-4-Methylsulfinyl-Butanoic Acid; 2-Acetamido-4-Methylsulfinyl-Butyric Acid; Butanoic Acid, 2-(Acetylamino)-4-(Methylsulfinyl)-
• Molecular Formula: C₇H₁₃NO₄S
• Molecular Weight: 207.24
• CAS Registry Number: 3054-51-1
• SMILES: C(C(NC(C)=O)C(O)=O)C[S](C)=O
• InChI: 1S/C7H13NO4S/c1-5(9)8-6(7(10)11)3-4-13(2)12/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)
• InChIKey: NPIMMZJBURSMON-UHFFFAOYSA-N

Properties

• Density: 1.341g/cm³ (Cal.)
• Boiling point: 587.33°C at 760 mmHg (Cal.)
• Flash point: 309.006°C (Cal.)