ChemSpider 2D Image | 6-Hydroxy-6-oxido-9-[(9Z)-9-tetradecenoyloxy]-5,7-dioxa-2-aza-6lambda~5~-phosphadecan-10-yl icosanoate | C40H78NO8P

6-Hydroxy-6-oxido-9-[(9Z)-9-tetradecenoyloxy]-5,7-dioxa-2-aza-6λ5-phosphadecan-10-yl icosanoate

  • Molecular FormulaC40H78NO8P
  • Average mass732.023 Da
  • Monoisotopic mass731.546509 Da
  • ChemSpider ID74850152

  • Double-bond stereo - Double-bond stereo

More details:

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

6-Hydroxy-6-oxido-9-[(9Z)-9-tetradecenoyloxy]-5,7-dioxa-2-aza-6λ5-phosphadecan-10-yl icosanoate [ACD/IUPAC Name]
6-Hydroxy-6-oxido-9-[(9Z)-9-tetradecenoyloxy]-5,7-dioxa-2-aza-6λ5-phosphadecan-10-yl-icosanoat [German] [ACD/IUPAC Name]
Eicosanoic acid, 3-[[hydroxy[2-(methylamino)ethoxy]phosphinyl]oxy]-2-[[(9Z)-1-oxo-9-tetradecen-1-yl]oxy]propyl ester [ACD/Index Name]
Icosanoate de 6-hydroxy-6-oxydo-9-[(9Z)-9-tetradecenoyloxy]-5,7-dioxa-2-aza-6λ5-phosphadécan-10-yle [French] [ACD/IUPAC Name]
[3-(icosanoyloxy)-2-[(9Z)-tetradec-9-enoyloxy]propoxy][2-(methylamino)ethoxy]phosphinic acid
3-(icosanoyloxy)-2-[(9Z)-tetradec-9-enoyloxy]propoxy(2-(methylamino)ethoxy)phosphinic acid
PE-NMe(20:0/14:1(9Z))

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: 742.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.3 mmHg at 25°C
Enthalpy of Vaporization: 117.9±6.0 kJ/mol
Flash Point: 402.9±35.7 °C
Index of Refraction: 1.475
Molar Refractivity: 206.4±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 41
#Rule of 5 Violations: 2
ACD/LogP: 14.48
ACD/LogD (pH 5.5): 9.59
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 284593.25
ACD/LogD (pH 7.4): 9.58
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 278205.66
Polar Surface Area: 130 Å2
Polarizability: 81.8±0.5 10-24cm3
Surface Tension: 37.5±3.0 dyne/cm
Molar Volume: 733.0±3.0 cm3

Click to predict properties on the Chemicalize site


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