2-[Cyclopentyl-[3-(2,2-Dimethylpropanoylsulfanyl)-2-Methylpropanoyl]Amino]Acetic Acid
[CAS# 76963-39-8]

Identification

• Name: 2-[Cyclopentyl-[3-(2,2-Dimethylpropanoylsulfanyl)-2-Methylpropanoyl]Amino]Acetic Acid
• Synonyms: 2-[Cyclopentyl-[3-(2,2-Dimethylpropanoylsulfanyl)-2-Methyl-Propanoyl]Amino]Acetic Acid; 2-[Cyclopentyl-[3-[(2,2-Dimethyl-1-Oxopropyl)Thio]-2-Methyl-1-Oxopropyl]Amino]Acetic Acid; 2-[Cyclopentyl-[2-Methyl-3-(Pivaloylthio)Propanoyl]Amino]Acetic Acid
• Molecular Formula: C₁₆H₂₇NO₄S
• Molecular Weight: 329.45
• CAS Registry Number: 76963-39-8
• SMILES: C(N(C1CCCC1)C(C(CSC(C(C)(C)C)=O)C)=O)C(O)=O
• InChI: 1S/C16H27NO4S/c1-11(10-22-15(21)16(2,3)4)14(20)17(9-13(18)19)12-7-5-6-8-12/h11-12H,5-10H2,1-4H3,(H,18,19)
• InChIKey: XRKXJJYSKUIIEN-UHFFFAOYSA-N

Properties

• Density: 1.16g/cm³ (Cal.)
• Boiling point: 490.431°C at 760 mmHg (Cal.)
• Flash point: 250.404°C (Cal.)