D-Alprenolol
[CAS# 23846-72-2]

Identification

• Name: D-Alprenolol
• Synonyms: 1-(2-Allylphenoxy)-3-(Isopropylamino)Propan-2-Ol; Spectrum2_001814; Spectrum_000168
• Molecular Formula: C₁₅H₂₃NO₂
• Molecular Weight: 249.35
• CAS Registry Number: 23846-72-2
• SMILES: C1=CC=CC(=C1OCC(CNC(C)C)O)CC=C
• InChI: 1S/C15H23NO2/c1-4-7-13-8-5-6-9-15(13)18-11-14(17)10-16-12(2)3/h4-6,8-9,12,14,16-17H,1,7,10-11H2,2-3H3
• InChIKey: PAZJSJFMUHDSTF-UHFFFAOYSA-N

Properties

• Density: 1.0±0.1g/cm³ (Cal.)
• Boiling point: 383.4±37.0°C at 760 mmHg (Cal.)
• Flash point: 185.7±26.5°C (Cal.)

References

• (1): Mario Orsi and Jonathan W. Essex. Permeability of drugs and hormones through a lipid bilayer: insights from dual-resolution molecular dynamics, Soft Matter, 2010, 6, 3797.