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Search term: 59664358 (Found by CSID)
ChemSpider 2D Image | (2R)-2-Hydroxy-3-(phosphonooxy)propyl (11Z)-11-docosenoate | C25H49O7P

(2R)-2-Hydroxy-3-(phosphonooxy)propyl (11Z)-11-docosenoate

  • Molecular FormulaC25H49O7P
  • Average mass492.626 Da
  • Monoisotopic mass492.321594 Da
  • ChemSpider ID59664358

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(11Z)-11-Docosénoate de (2R)-2-hydroxy-3-(phosphonooxy)propyle [French] [ACD/IUPAC Name]
(2R)-2-Hydroxy-3-(phosphonooxy)propyl (11Z)-11-docosenoate [ACD/IUPAC Name]
(2R)-2-Hydroxy-3-(phosphonooxy)propyl-(11Z)-11-docosenoat [German] [ACD/IUPAC Name]
11-Docosenoic acid, (2R)-2-hydroxy-3-(phosphonooxy)propyl ester, (11Z)- [ACD/Index Name]
(2R)-3-[(11Z)-docos-11-enoyloxy]-2-hydroxypropoxyphosphonic acid
[(2R)-3-[(11Z)-docos-11-enoyloxy]-2-hydroxypropoxy]phosphonic acid
1-(11Z-docosenoyl)-glycero-3-phosphate
1-(11Z-Docosenoyl)-glycero-3-phosphoric acid
LPA(22:1)
PA(22:1(11Z)/0:0)

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: 1.1±0.1 g/cm3
Boiling Point: 621.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.1 mmHg at 25°C
Enthalpy of Vaporization: 105.6±6.0 kJ/mol
Flash Point: 329.8±34.3 °C
Index of Refraction: 1.487
Molar Refractivity: 132.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 25
#Rule of 5 Violations: 1
ACD/LogP: 8.31
ACD/LogD (pH 5.5): 3.68
ACD/BCF (pH 5.5): 57.91
ACD/KOC (pH 5.5): 71.11
ACD/LogD (pH 7.4): 2.74
ACD/BCF (pH 7.4): 6.70
ACD/KOC (pH 7.4): 8.22
Polar Surface Area: 123 Å2
Polarizability: 52.7±0.5 10-24cm3
Surface Tension: 42.4±3.0 dyne/cm
Molar Volume: 461.7±3.0 cm3

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