ChemSpider 2D Image | (17E)-27-Amino-24-hydroxy-24-oxido-19,23,25-trioxa-24lambda~5~-phosphaheptacos-17-en-21-yl (4Z,7Z,10Z,13Z,16Z)-4,7,10,13,16-icosapentaenoate | C43H76NO7P

(17E)-27-Amino-24-hydroxy-24-oxido-19,23,25-trioxa-24λ5-phosphaheptacos-17-en-21-yl (4Z,7Z,10Z,13Z,16Z)-4,7,10,13,16-icosapentaenoate

  • Molecular FormulaC43H76NO7P
  • Average mass750.040 Da
  • Monoisotopic mass749.535950 Da
  • ChemSpider ID24608296

  • Double-bond stereo - Double-bond stereo

More details:

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

(17E)-27-Amino-24-hydroxy-24-oxido-19,23,25-trioxa-24λ5-phosphaheptacos-17-en-21-yl (4Z,7Z,10Z,13Z,16Z)-4,7,10,13,16-icosapentaenoate [ACD/IUPAC Name]
(17E)-27-Amino-24-hydroxy-24-oxido-19,23,25-trioxa-24λ5-phosphaheptacos-17-en-21-yl-(4Z,7Z,10Z,13Z,16Z)-4,7,10,13,16-icosapentaenoat [German] [ACD/IUPAC Name]
(4Z,7Z,10Z,13Z,16Z)-4,7,10,13,16-Icosapentaénoate de (17E)-27-amino-24-hydroxy-24-oxydo-19,23,25-trioxa-24λ5-phosphaheptacos-17-én-21-yle [French] [ACD/IUPAC Name]
4,7,10,13,16-Eicosapentaenoic acid, 2-[[(2-aminoethoxy)hydroxyphosphinyl]oxy]-1-[[(1E)-1-octadecen-1-yloxy]methyl]ethyl ester, (4Z,7Z,10Z,13Z,16Z)- [ACD/Index Name]
Phosphatidylethanolamine alkenyl 18:0-20:5

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

Density: 1.0±0.1 g/cm3
Boiling Point: 766.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.6 mmHg at 25°C
Enthalpy of Vaporization: 121.4±6.0 kJ/mol
Flash Point: 417.4±35.7 °C
Index of Refraction: 1.501
Molar Refractivity: 220.5±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 39
#Rule of 5 Violations: 2
ACD/LogP: 14.58
ACD/LogD (pH 5.5): 9.67
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 314648.13
ACD/LogD (pH 7.4): 9.58
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 253963.23
Polar Surface Area: 127 Å2
Polarizability: 87.4±0.5 10-24cm3
Surface Tension: 38.6±3.0 dyne/cm
Molar Volume: 748.3±3.0 cm3

Click to predict properties on the Chemicalize site


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