ChemSpider 2D Image | 17-Amino-1-(2-hexylcyclopropyl)-14-hydroxy-14-oxido-8-oxo-9,13,15-trioxa-14lambda~5~-phosphaheptadecan-11-yl palmitate | C38H74NO8P

17-Amino-1-(2-hexylcyclopropyl)-14-hydroxy-14-oxido-8-oxo-9,13,15-trioxa-14λ5-phosphaheptadecan-11-yl palmitate

  • Molecular FormulaC38H74NO8P
  • Average mass703.970 Da
  • Monoisotopic mass703.515198 Da
  • ChemSpider ID84497008

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

17-Amino-1-(2-hexylcyclopropyl)-14-hydroxy-14-oxido-8-oxo-9,13,15-trioxa-14λ5-phosphaheptadecan-11-yl palmitate [ACD/IUPAC Name]
17-Amino-1-(2-hexylcyclopropyl)-14-hydroxy-14-oxido-8-oxo-9,13,15-trioxa-14λ5-phosphaheptadecan-11-ylpalmitat [German] [ACD/IUPAC Name]
Cyclopropaneoctanoic acid, 2-hexyl-, 3-[[(2-aminoethoxy)hydroxyphosphinyl]oxy]-2-[(1-oxohexadecyl)oxy]propyl ester [ACD/Index Name]
Palmitate de 17-amino-1-(2-hexylcyclopropyl)-14-hydroxy-8-oxo-14-oxydo-9,13,15-trioxa-14λ5-phosphaheptadécan-11-yle [French] [ACD/IUPAC Name]
[1-[2-Aminoethoxy(hydroxy)phosphoryl]oxy-3-[8-(2-hexylcyclopropyl)octanoyloxy]propan-2-yl] hexadecanoate
Compound NP-021904

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 733.8±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.2 mmHg at 25°C
Enthalpy of Vaporization: 116.6±6.0 kJ/mol
Flash Point: 397.6±35.7 °C
Index of Refraction: 1.481
Molar Refractivity: 195.1±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 38
#Rule of 5 Violations: 2
ACD/LogP: 13.50
ACD/LogD (pH 5.5): 9.51
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 256658.78
ACD/LogD (pH 7.4): 9.41
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 206773.34
Polar Surface Area: 144 Å2
Polarizability: 77.3±0.5 10-24cm3
Surface Tension: 40.2±3.0 dyne/cm
Molar Volume: 685.5±3.0 cm3

Click to predict properties on the Chemicalize site


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