N-[(1R,2R)-1-(1,3-Benzodioxol-5-Yl)-1-Hydroxy-3-(1-Pyrrolidinyl)-2-Propanyl]Hexadecanamide
[CAS# 245329-80-0]

Identification

• Name: N-[(1R,2R)-1-(1,3-Benzodioxol-5-Yl)-1-Hydroxy-3-(1-Pyrrolidinyl)-2-Propanyl]Hexadecanamide
• Synonyms: Hexadecanamide, N-[(1R,2R)-2-(1,3-benzodioxol-5-yl)-2-hydroxy-1-(1-pyrrolidinylmethyl)ethyl]-; Hexadecanamide,N-[(1R,2R)-2-(1,3-benzodioxol-5-yl)-2-hydroxy-1-(1-pyrrolidinylmethyl)ethyl]-
• Molecular Formula: C₃₀H₅₀N₂O₄
• Molecular Weight: 502.73
• CAS Registry Number: 245329-80-0
• SMILES: CCCCCCCCCCCCCCCC(=O)NC(CN1CCCC1)C(c2ccc3c(c2)OCO3)O
• InChI: 1S/C30H50N2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-29(33)31-26(23-32-20-15-16-21-32)30(34)25-18-19-27-28(22-25)36-24-35-27/h18-19,22,26,30,34H,2-17,20-21,23-24H2,1H3,(H,31,33)/t26-,30-/m1/s1
• InChIKey: UHZDWEWCADTCKW-PDDLMNHVSA-N

Properties

• Density: 1.06g/cm³ (Cal.)
• Boiling point: 674.267°C at 760 mmHg (Cal.)
• Flash point: 361.584°C (Cal.)
• Refractive index: 1.527 (Cal.)