(2S,3S)-3-(Dibenzylamino)-2-hydroxy-4-phenylbutyl (2E)-2-pentenoate
[CAS# 871949-03-0]

Identification

• Name: (2S,3S)-3-(Dibenzylamino)-2-hydroxy-4-phenylbutyl (2E)-2-pentenoate
• Molecular Formula: C₂₉H₃₃NO₃
• Molecular Weight: 443.58
• CAS Registry Number: 871949-03-0
• SMILES: O=C(OC[C@@H](O)[C@@H](N(Cc1ccccc1)Cc2ccccc2)Cc3ccccc3)/C=C/CC
• InChI: 1S/C29H33NO3/c1-2-3-19-29(32)33-23-28(31)27(20-24-13-7-4-8-14-24)30(21-25-15-9-5-10-16-25)22-26-17-11-6-12-18-26/h3-19,27-28,31H,2,20-23H2,1H3/b19-3+/t27-,28+/m0/s1
• InChIKey: NYEZVINCEJVQNO-OTVSBJOASA-N

Properties

• Density: 1.123g/cm³ (Cal.)
• Boiling point: 596.289°C at 760 mmHg (Cal.)
• Flash point: 314.424°C (Cal.)
• Refractive index: 1.591 (Cal.)