4-(2-acetamido-3-hydroxy-3-oxo-propyl)sulfanyl-2-oxo-butanoic acid
[CAS# 622368-00-7]

Identification

• Name: 4-(2-acetamido-3-hydroxy-3-oxo-propyl)sulfanyl-2-oxo-butanoic acid
• Synonyms: (R)-4-(2-acetamido-2-carboxyethylthio)-2-oxobutanoic acid
• Molecular Formula: C₉H₁₃NO₆S
• Molecular Weight: 263.27
• CAS Registry Number: 622368-00-7
• SMILES: O=C(C)NC(CSCCC(=O)C(O)=O)C(O)=O
• InChI: 1S/C9H13NO6S/c1-5(11)10-6(8(13)14)4-17-3-2-7(12)9(15)16/h6H,2-4H2,1H3,(H,10,11)(H,13,14)(H,15,16)
• InChIKey: AHFWWWFNCBRMIV-UHFFFAOYSA-N

Properties

• Density: 1.433g/cm³ (Cal.)
• Boiling point: 578.768°C at 760 mmHg (Cal.)
• Flash point: 303.828°C (Cal.)
• Refractive index: 1.549 (Cal.)