3-[(3-Methyl-3-Sulfanylbutanoyl)Amino]Propanoic Acid
[CAS# 131068-51-4]

Identification

• Name: 3-[(3-Methyl-3-Sulfanylbutanoyl)Amino]Propanoic Acid
• Synonyms: 3-[(3-Methyl-3-Sulfanyl-Butanoyl)Amino]Propanoic Acid; 3-[(3-Mercapto-3-Methyl-1-Oxobutyl)Amino]Propanoic Acid; 3-[(3-Mercapto-3-Methyl-Butanoyl)Amino]Propionic Acid
• Molecular Formula: C₈H₁₅NO₃S
• Molecular Weight: 205.27
• CAS Registry Number: 131068-51-4
• SMILES: C(C(O)=O)CNC(CC(S)(C)C)=O
• InChI: 1S/C8H15NO3S/c1-8(2,13)5-6(10)9-4-3-7(11)12/h13H,3-5H2,1-2H3,(H,9,10)(H,11,12)
• InChIKey: QMPIELCZGATVNY-UHFFFAOYSA-N

Properties

• Density: 1.171g/cm³ (Cal.)
• Boiling point: 433.796°C at 760 mmHg (Cal.)
• Flash point: 216.152°C (Cal.)