(6R)-3-{1-[3-(Dibenzylamino)Phenyl]Propyl}-4-Hydroxy-6-(2-Phenylethyl)-6-(1-Propyn-1-Yl)-5,6-Dihydro-2H-Pyran-2-One
[CAS# 188559-25-3]

Identification

• Name: (6R)-3-{1-[3-(Dibenzylamino)Phenyl]Propyl}-4-Hydroxy-6-(2-Phenylethyl)-6-(1-Propyn-1-Yl)-5,6-Dihydro-2H-Pyran-2-One
• Synonyms: [R-(R*,R*)]-3-[1-[3-[Bis(phenylmethyl)amino]phenyl]propyl]-5,6-dihydro-4-hydroxy-6-(2-phenylethyl)-6-(1-propynyl)-2H-pyran-2-one
• Molecular Formula: C₃₉H₃₉NO₃
• Molecular Weight: 569.73
• CAS Registry Number: 188559-25-3
• SMILES: CCC(c1cccc(c1)N(Cc2ccccc2)Cc3ccccc3)C4=C(C[C@](OC4=O)(CCc5ccccc5)C#CC)O
• InChI: 1S/C39H39NO3/c1-3-24-39(25-23-30-15-8-5-9-16-30)27-36(41)37(38(42)43-39)35(4-2)33-21-14-22-34(26-33)40(28-31-17-10-6-11-18-31)29-32-19-12-7-13-20-32/h5-22,26,35,41H,4,23,25,27-29H2,1-2H3/t35?,39-/m1/s1
• InChIKey: AFDVQNNCQVMKOI-ZOMBWJMTSA-N

Properties

• Density: 1.198g/cm³ (Cal.)
• Boiling point: 757.422°C at 760 mmHg (Cal.)
• Flash point: 411.874°C (Cal.)
• Refractive index: 1.648 (Cal.)