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Search term: 74850298 (Found by CSID)
ChemSpider 2D Image | 6-Hydroxy-6-oxido-9-(stearoyloxy)-5,7-dioxa-2-aza-6lambda~5~-phosphadecan-10-yl (5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoate | C44H80NO8P

6-Hydroxy-6-oxido-9-(stearoyloxy)-5,7-dioxa-2-aza-6λ5-phosphadecan-10-yl (5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoate

  • Molecular FormulaC44H80NO8P
  • Average mass782.082 Da
  • Monoisotopic mass781.562134 Da
  • ChemSpider ID74850298

  • Double-bond stereo - Double-bond stereo

More details:

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

(5Z,8Z,11Z,14Z)-5,8,11,14-Icosatétraénoate de 6-hydroxy-6-oxydo-9-(stearoyloxy)-5,7-dioxa-2-aza-6λ5-phosphadécan-10-yle [French] [ACD/IUPAC Name]
5,8,11,14-Eicosatetraenoic acid, 3-[[hydroxy[2-(methylamino)ethoxy]phosphinyl]oxy]-2-[(1-oxooctadecyl)oxy]propyl ester, (5Z,8Z,11Z,14Z)- [ACD/Index Name]
6-Hydroxy-6-oxido-9-(stearoyloxy)-5,7-dioxa-2-aza-6λ5-phosphadecan-10-yl (5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoate [ACD/IUPAC Name]
6-Hydroxy-6-oxido-9-(stearoyloxy)-5,7-dioxa-2-aza-6λ5-phosphadecan-10-yl-(5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoat [German] [ACD/IUPAC Name]
{3-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]-2-(octadecanoyloxy)propoxy}[2-(methylamino)ethoxy]phosphinic acid
3-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]-2-(octadecanoyloxy)propoxy(2-(methylamino)ethoxy)phosphinic acid
PE-NMe(20:4(5Z,8Z,11Z,14Z)/18:0)

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

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

Density: 1.0±0.1 g/cm3
Boiling Point: 777.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.8 mmHg at 25°C
Enthalpy of Vaporization: 123.0±6.0 kJ/mol
Flash Point: 423.8±35.7 °C
Index of Refraction: 1.489
Molar Refractivity: 225.1±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 42
#Rule of 5 Violations: 2
ACD/LogP: 14.85
ACD/LogD (pH 5.5): 10.40
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 783618.13
ACD/LogD (pH 7.4): 10.39
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 766029.31
Polar Surface Area: 130 Å2
Polarizability: 89.2±0.5 10-24cm3
Surface Tension: 37.9±3.0 dyne/cm
Molar Volume: 779.8±3.0 cm3

Click to predict properties on the Chemicalize site


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