ChemSpider 2D Image | 1-linoleyl-sn-glycerol 3-phosphate | C21H39O7P

1-linoleyl-sn-glycerol 3-phosphate

  • Molecular FormulaC21H39O7P
  • Average mass434.504 Da
  • Monoisotopic mass434.243347 Da
  • ChemSpider ID24766514

  • 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

(2R)-2-Hydroxy-3-(phosphonooxy)propyl (9Z,12Z)-9,12-octadecadienoate [ACD/IUPAC Name]
(2R)-2-Hydroxy-3-(phosphonooxy)propyl-(9Z,12Z)-9,12-octadecadienoat [German] [ACD/IUPAC Name]
(9Z,12Z)-9,12-Octadécadiénoate de (2R)-2-hydroxy-3-(phosphonooxy)propyle [French] [ACD/IUPAC Name]
1-linoleoyl-sn-glycerol 3-phosphate
1-linoleyl-sn-glycerol 3-phosphate
9,12-Octadecadienoic acid, (2R)-2-hydroxy-3-(phosphonooxy)propyl ester, (9Z,12Z)- [ACD/Index Name]
(2R)-2-hydroxy-3-(phosphonooxy)propyl (9Z,12Z)-octadeca-9,12-dienoate
(2R)-2-hydroxy-3-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propoxyphosphonic acid
(9Z,12Z)-(R)-2-Hydroxy-3-(phosphonooxy)propyl octadeca-9,12-dienoate
[(2R)-2-hydroxy-3-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propoxy]phosphonic acid
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 582.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.7 mmHg at 25°C
Enthalpy of Vaporization: 99.9±6.0 kJ/mol
Flash Point: 305.8±32.9 °C
Index of Refraction: 1.500
Molar Refractivity: 114.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 1
ACD/LogP: 5.66
ACD/LogD (pH 5.5): 1.39
ACD/BCF (pH 5.5): 1.06
ACD/KOC (pH 5.5): 4.06
ACD/LogD (pH 7.4): 0.46
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 123 Å2
Polarizability: 45.4±0.5 10-24cm3
Surface Tension: 44.6±3.0 dyne/cm
Molar Volume: 389.3±3.0 cm3

Click to predict properties on the Chemicalize site


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