Found 1 result

Search term: CCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCC)COP(O)(O)=O (Found by conversion of search term to chemical structure (full match))
ChemSpider 2D Image | (2R)-1-(Dodecanoyloxy)-3-(phosphonooxy)-2-propanyl myristate | C29H57O8P

(2R)-1-(Dodecanoyloxy)-3-(phosphonooxy)-2-propanyl myristate

  • Molecular FormulaC29H57O8P
  • Average mass564.732 Da
  • Monoisotopic mass564.379089 Da
  • ChemSpider ID25056823

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1r)-2-(Dodecanoyloxy)-1-[(Phosphonooxy)methyl]ethyl Tetradecanoate
(2R)-1-(Dodecanoyloxy)-3-(phosphonooxy)-2-propanyl myristate [ACD/IUPAC Name]
(2R)-1-(Dodecanoyloxy)-3-(phosphonooxy)-2-propanylmyristat [German] [ACD/IUPAC Name]
Myristate de (2R)-1-(dodecanoyloxy)-3-(phosphonooxy)-2-propanyle [French] [ACD/IUPAC Name]
Tetradecanoic acid, (1R)-2-[(1-oxododecyl)oxy]-1-[(phosphonooxy)methyl]ethyl ester [ACD/Index Name]
1,2-DIACYL-GLYCEROL-3-SN-PHOSPHATE
1-dodecanoyl-2-tetradecanoyl-glycero-3-phosphate
3PH
7PH
PA(12:0/14:0)
More...

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

Density: 1.0±0.1 g/cm3
Boiling Point: 648.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.2 mmHg at 25°C
Enthalpy of Vaporization: 104.4±6.0 kJ/mol
Flash Point: 346.3±34.3 °C
Index of Refraction: 1.473
Molar Refractivity: 151.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 30
#Rule of 5 Violations: 2
ACD/LogP: 10.48
ACD/LogD (pH 5.5): 6.28
ACD/BCF (pH 5.5): 5459.05
ACD/KOC (pH 5.5): 1817.76
ACD/LogD (pH 7.4): 5.35
ACD/BCF (pH 7.4): 642.31
ACD/KOC (pH 7.4): 213.88
Polar Surface Area: 129 Å2
Polarizability: 60.1±0.5 10-24cm3
Surface Tension: 40.0±3.0 dyne/cm
Molar Volume: 540.1±3.0 cm3

Click to predict properties on the Chemicalize site


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