(3S)-3-(2-Sulfanyl-2-Propanyl)-2,5-Piperazinedione
[CAS# 175694-44-7]

Identification

• Name: (3S)-3-(2-Sulfanyl-2-Propanyl)-2,5-Piperazinedione
• Synonyms: (S)-3-(2-mercaptopropan-2-yl)piperazine-2,5-dione
• Molecular Formula: C₇H₁₂N₂O₂S
• Molecular Weight: 188.25
• CAS Registry Number: 175694-44-7
• SMILES: CC(C)([C@@H]1C(=O)NCC(=O)N1)S
• InChI: 1S/C7H12N2O2S/c1-7(2,12)5-6(11)8-3-4(10)9-5/h5,12H,3H2,1-2H3,(H,8,11)(H,9,10)/t5-/m0/s1
• InChIKey: VTNPXGAUAFMWPE-YFKPBYRVSA-N

Properties

• Density: 1.212g/cm³ (Cal.)
• Boiling point: 509.304°C at 760 mmHg (Cal.)
• Flash point: 261.818°C (Cal.)
• Refractive index: 1.515 (Cal.)