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Search term: 113379497 (Found by CSID)
ChemSpider 2D Image | (2R)-2-Hydroxy-3-(phosphonooxy)propyl (9Z)-9-nonadecenoate | C22H43O7P

(2R)-2-Hydroxy-3-(phosphonooxy)propyl (9Z)-9-nonadecenoate

  • Molecular FormulaC22H43O7P
  • Average mass450.546 Da
  • Monoisotopic mass450.274628 Da
  • ChemSpider ID113379497

  • 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)-9-nonadecenoate [ACD/IUPAC Name]
(2R)-2-Hydroxy-3-(phosphonooxy)propyl-(9Z)-9-nonadecenoat [German] [ACD/IUPAC Name]
(9Z)-9-Nonadécénoate de (2R)-2-hydroxy-3-(phosphonooxy)propyle [French] [ACD/IUPAC Name]
9-Nonadecenoic acid, (2R)-2-hydroxy-3-(phosphonooxy)propyl ester, (9Z)- [ACD/Index Name]
1-(9Z-nonadecenoyl)-glycero-3-phosphate
LPA(19:1)
PA(19:1(9Z)/0:0)

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

Density: 1.1±0.1 g/cm3
Boiling Point: 591.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.8 mmHg at 25°C
Enthalpy of Vaporization: 101.3±6.0 kJ/mol
Flash Point: 311.6±32.9 °C
Index of Refraction: 1.489
Molar Refractivity: 119.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 22
#Rule of 5 Violations: 1
ACD/LogP: 6.71
ACD/LogD (pH 5.5): 2.46
ACD/BCF (pH 5.5): 6.91
ACD/KOC (pH 5.5): 15.52
ACD/LogD (pH 7.4): 1.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.79
Polar Surface Area: 123 Å2
Polarizability: 47.2±0.5 10-24cm3
Surface Tension: 43.5±3.0 dyne/cm
Molar Volume: 412.2±3.0 cm3

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