N-[(1R,2R)-1-(3,4-Dihydro-2H-1,5-Benzodioxepin-7-Yl)-1-Hydroxy-3-(1-Pyrrolidinyl)-2-Propanyl]Hexadecanamide
[CAS# 245329-79-7]

Identification

• Name: N-[(1R,2R)-1-(3,4-Dihydro-2H-1,5-Benzodioxepin-7-Yl)-1-Hydroxy-3-(1-Pyrrolidinyl)-2-Propanyl]Hexadecanamide
• Synonyms: Hexadecanamide, N-[(1R,2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-hydroxy-1-(1-pyrrolidinylmethyl)ethyl]; HEXADECANAMIDE,N-[(1R,2R)-2-(3,4-DIHYDRO-2H-1,5-BENZODIOXEPIN-7-YL)-2-HYDROXY-1-(1-PYRROLIDINYLMETHYL)ETHYL]-
• Molecular Formula: C₃₂H₅₄N₂O₄
• Molecular Weight: 530.78
• CAS Registry Number: 245329-79-7
• SMILES: CCCCCCCCCCCCCCCC(=O)NC(CN1CCCC1)C(c2ccc3c(c2)OCCCO3)O
• InChI: 1S/C32H54N2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-31(35)33-28(26-34-21-15-16-22-34)32(36)27-19-20-29-30(25-27)38-24-17-23-37-29/h19-20,25,28,32,36H,2-18,21-24,26H2,1H3,(H,33,35)/t28-,32-/m1/s1
• InChIKey: OTCOAZANZBJVBF-AKGWNBJDSA-N

Properties

• Density: 1.041g/cm³ (Cal.)
• Boiling point: 694.505°C at 760 mmHg (Cal.)
• Flash point: 373.823°C (Cal.)
• Refractive index: 1.52 (Cal.)