ChemSpider 2D Image | (20Z)-6-Hydroxy-2-methyl-6-oxido-12-oxo-5,7,11-trioxa-2-aza-6lambda~5~-phosphapentacos-20-en-9-yl (11Z)-11-octadecenoate | C39H74NO8P

(20Z)-6-Hydroxy-2-methyl-6-oxido-12-oxo-5,7,11-trioxa-2-aza-6λ5-phosphapentacos-20-en-9-yl (11Z)-11-octadecenoate

  • Molecular FormulaC39H74NO8P
  • Average mass715.981 Da
  • Monoisotopic mass715.515198 Da
  • ChemSpider ID74850637

  • Double-bond stereo - Double-bond stereo

More details:

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

(11Z)-11-Octadécénoate de (20Z)-6-hydroxy-2-méthyl-12-oxo-6-oxydo-5,7,11-trioxa-2-aza-6λ5-phosphapentacos-20-én-9-yle [French] [ACD/IUPAC Name]
(20Z)-6-Hydroxy-2-methyl-6-oxido-12-oxo-5,7,11-trioxa-2-aza-6λ5-phosphapentacos-20-en-9-yl (11Z)-11-octadecenoate [ACD/IUPAC Name]
(20Z)-6-Hydroxy-2-methyl-6-oxido-12-oxo-5,7,11-trioxa-2-aza-6λ5-phosphapentacos-20-en-9-yl-(11Z)-11-octadecenoat [German] [ACD/IUPAC Name]
11-Octadecenoic acid, 2-[[[2-(dimethylamino)ethoxy]hydroxyphosphinyl]oxy]-1-[[[(9Z)-1-oxo-9-tetradecen-1-yl]oxy]methyl]ethyl ester, (11Z)- [ACD/Index Name]
[2-(dimethylamino)ethoxy]({2-[(11Z)-octadec-11-enoyloxy]-3-[(9Z)-tetradec-9-enoyloxy]propoxy})phosphinic acid
2-(dimethylamino)ethoxy(2-[(11Z)-octadec-11-enoyloxy]-3-[(9Z)-tetradec-9-enoyloxy]propoxy)phosphinic acid
PE-NMe2(14:1(9Z)/18:1(11Z))

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: 725.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.1 mmHg at 25°C
Enthalpy of Vaporization: 115.3±6.0 kJ/mol
Flash Point: 392.4±35.7 °C
Index of Refraction: 1.482
Molar Refractivity: 202.0±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 38
#Rule of 5 Violations: 2
ACD/LogP: 13.40
ACD/LogD (pH 5.5): 7.90
ACD/BCF (pH 5.5): 150327.25
ACD/KOC (pH 5.5): 34408.14
ACD/LogD (pH 7.4): 7.87
ACD/BCF (pH 7.4): 140344.33
ACD/KOC (pH 7.4): 32123.16
Polar Surface Area: 121 Å2
Polarizability: 80.1±0.5 10-24cm3
Surface Tension: 38.0±3.0 dyne/cm
Molar Volume: 708.5±3.0 cm3

Click to predict properties on the Chemicalize site


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