Cyclo(-Phe-Trp)
[CAS# 82597-82-8]

Identification

• Name: Cyclo(-Phe-Trp)
• Synonyms: 3-(Benzyl)-6-(1H-Indol-3-Ylmethyl)Piperazine-2,5-Quinone; 2,5-Piperazinedione, 3-(1H-Indol-3-Ylmethyl)-6-(Phenylmethyl)-; Acon0_001421
• Molecular Formula: C₂₀H₁₉N₃O₂
• Molecular Weight: 333.39
• CAS Registry Number: 82597-82-8
• SMILES: C1=CC=CC2=C1C(=C[NH]2)CC4C(NC(CC3=CC=CC=C3)C(N4)=O)=O
• InChI: 1S/C20H19N3O2/c24-19-17(10-13-6-2-1-3-7-13)22-20(25)18(23-19)11-14-12-21-16-9-5-4-8-15(14)16/h1-9,12,17-18,21H,10-11H2,(H,22,25)(H,23,24)
• InChIKey: CUVKAUWOMPJEMI-UHFFFAOYSA-N

Properties

• Density: 1.279g/cm³ (Cal.)
• Boiling point: 705.471°C at 760 mmHg (Cal.)
• Flash point: 380.455°C (Cal.)