L-N-Acetyl-3-((2-Chloro-2-Methylpropyl)Thio)-Alanine Methyl Ester
[CAS# 102516-58-5]

Identification

• Name: L-N-Acetyl-3-((2-Chloro-2-Methylpropyl)Thio)-Alanine Methyl Ester
• Synonyms: Methyl 2-Acetamido-3-(2-Chloro-2-Methyl-Propyl)Sulfanyl-Propanoate; 2-Acetamido-3-[(2-Chloro-2-Methylpropyl)Thio]Propanoic Acid Methyl Ester; 2-Acetamido-3-[(2-Chloro-2-Methyl-Propyl)Thio]Propionic Acid Methyl Ester
• Molecular Formula: C₁₀H₁₈ClNO₃S
• Molecular Weight: 267.77
• CAS Registry Number: 102516-58-5
• SMILES: C(C(C(OC)=O)NC(C)=O)SCC(C)(C)Cl
• InChI: 1S/C10H18ClNO3S/c1-7(13)12-8(9(14)15-4)5-16-6-10(2,3)11/h8H,5-6H2,1-4H3,(H,12,13)
• InChIKey: DWACJOIQJASOHA-UHFFFAOYSA-N

Properties

• Density: 1.17g/cm³ (Cal.)
• Boiling point: 424.003°C at 760 mmHg (Cal.)
• Flash point: 210.229°C (Cal.)