ChemSpider 2D Image | (15Z)-3-Amino-6-hydroxy-6-oxido-2,12-dioxo-5,7,11-trioxa-6lambda~5~-phosphanonacos-15-en-9-yl (4Z)-4-octadecenoate | C43H80NO9P

(15Z)-3-Amino-6-hydroxy-6-oxido-2,12-dioxo-5,7,11-trioxa-6λ5-phosphanonacos-15-en-9-yl (4Z)-4-octadecenoate

  • Molecular FormulaC43H80NO9P
  • Average mass786.070 Da
  • Monoisotopic mass785.557068 Da
  • ChemSpider ID24608497
  • Double-bond stereo - Double-bond stereo


More details:






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

(15Z)-3-Amino-6-hydroxy-6-oxido-2,12-dioxo-5,7,11-trioxa-5-phosphanonacos-15-en-9-yl (4Z)-4-octadecenoate [ACD/IUPAC Name]
(15Z)-3-Amino-6-hydroxy-6-oxido-2,12-dioxo-5,7,11-trioxa-5-phosphanonacos-15-en-9-yl-(4Z)-4-octadecenoat [German] [ACD/IUPAC Name]
(4Z)-4-Octadécénoate de (15Z)-3-amino-6-hydroxy-2,12-dioxo-6-oxydo-5,7,11-trioxa-6λ5-phosphanonacos-15-én-9-yle [French] [ACD/IUPAC Name]
4-Octadecenoic acid, 1-[[[(2-amino-3-oxobutoxy)hydroxyphosphinyl]oxy]methyl]-1,2-ethanediyl ester, (4Z,4'Z)- [ACD/Index Name]
Phosphatidylserine 18:1-18:1

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

Density: 1.0±0.1 g/cm3
Boiling Point: 794.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.0 mmHg at 25°C
Enthalpy of Vaporization: 125.5±6.0 kJ/mol
Flash Point: 434.0±35.7 °C
Index of Refraction: 1.485
Molar Refractivity: 220.3±0.3 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 42
#Rule of 5 Violations: 3
ACD/LogP: 15.61
ACD/LogD (pH 5.5): 10.10
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 355146.78
ACD/LogD (pH 7.4): 9.53
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 94681.05
Polar Surface Area: 161 Å2
Polarizability: 87.3±0.5 10-24cm3
Surface Tension: 39.3±3.0 dyne/cm
Molar Volume: 768.4±3.0 cm3

Click to predict properties on the Chemicalize site






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