1-[(1E)-1,3-Butadien-1-Yl]-5-Oxo-L-Proline
[CAS# 391937-24-9]

Identification

• Name: 1-[(1E)-1,3-Butadien-1-Yl]-5-Oxo-L-Proline
• Synonyms: (S,E)-1-(buta-1,3-dien-1-yl)-5-oxopyrrolidine-2-carboxylic acid
• Molecular Formula: C₉H₁₁NO₃
• Molecular Weight: 181.19
• CAS Registry Number: 391937-24-9
• SMILES: C=C/C=C/N1[C@@H](CCC1=O)C(=O)O
• InChI: 1S/C9H11NO3/c1-2-3-6-10-7(9(12)13)4-5-8(10)11/h2-3,6-7H,1,4-5H2,(H,12,13)/b6-3+/t7-/m0/s1
• InChIKey: GBHXILOOFFQLOS-ZAXDUSRUSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 409.5±34.0°C at 760 mmHg (Cal.)
• Flash point: 201.5±25.7°C (Cal.)
• Refractive index: 1.629 (Cal.)