(2S)-1-[3-(1-Ethyl-2,5-Dioxopyrrolidin-3-Yl)Sulfinyl-2-Methylpropanoyl]Pyrrolidine-2-Carboxylic Acid
[CAS# 109350-29-0]

Identification

• Name: (2S)-1-[3-(1-Ethyl-2,5-Dioxopyrrolidin-3-Yl)Sulfinyl-2-Methylpropanoyl]Pyrrolidine-2-Carboxylic Acid
• Synonyms: (2S)-1-[3-(1-Ethyl-2,5-Dioxo-Pyrrolidin-3-Yl)Sulfinyl-2-Methyl-Propanoyl]Pyrrolidine-2-Carboxylic Acid; (2S)-1-[3-[(1-Ethyl-2,5-Dioxo-3-Pyrrolidinyl)Sulfinyl]-2-Methyl-1-Oxopropyl]-2-Pyrrolidinecarboxylic Acid; (2S)-1-[3-(1-Ethyl-2,5-Diketo-Pyrrolidin-3-Yl)Sulfinyl-2-Methyl-Propanoyl]Proline
• Molecular Formula: C₁₅H₂₂N₂O₆S
• Molecular Weight: 358.41
• CAS Registry Number: 109350-29-0
• SMILES: [C@H]1(C(=O)O)N(CCC1)C(C(C[S](=O)C2C(N(C(C2)=O)CC)=O)C)=O
• InChI: 1S/C15H22N2O6S/c1-3-16-12(18)7-11(14(16)20)24(23)8-9(2)13(19)17-6-4-5-10(17)15(21)22/h9-11H,3-8H2,1-2H3,(H,21,22)/t9?,10-,11?,24?/m0/s1
• InChIKey: CPLQYASJOXYLAN-YJLTZIBZSA-N

Properties

• Density: 1.441g/cm³ (Cal.)
• Boiling point: 706.269°C at 760 mmHg (Cal.)
• Flash point: 380.938°C (Cal.)