ChemSpider 2D Image | DG(14:1(9Z)/22:0/0:0) | C39H74O5

DG(14:1(9Z)/22:0/0:0)

  • Molecular FormulaC39H74O5
  • Average mass623.002 Da
  • Monoisotopic mass622.553650 Da
  • ChemSpider ID24765891

  • 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

(2S)-1-Hydroxy-3-[(9Z)-9-tetradecenoyloxy]-2-propanyl docosanoate [ACD/IUPAC Name]
(2S)-1-Hydroxy-3-[(9Z)-9-tetradecenoyloxy]-2-propanyl-docosanoat [German] [ACD/IUPAC Name]
DG(14:1(9Z)/22:0/0:0)
Docosanoate de (2S)-1-hydroxy-3-[(9Z)-9-tetradecenoyloxy]-2-propanyle [French] [ACD/IUPAC Name]
Docosanoic acid, (1S)-2-hydroxy-1-[[[(9Z)-1-oxo-9-tetradecen-1-yl]oxy]methyl]ethyl ester [ACD/Index Name]
(2S)-1-hydroxy-3-[(9Z)-tetradec-9-enoyloxy]propan-2-yl docosanoate
1-(9Z-tetradecenoyl)-2-docosanoyl-sn-glycerol
1-Myristoleoyl-2-behenoyl-sn-glycerol
DAG(14:1/22:0)
DAG(14:1n5/22:0)
More...

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: 0.9±0.1 g/cm3
Boiling Point: 668.2±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.6 mmHg at 25°C
Enthalpy of Vaporization: 112.4±6.0 kJ/mol
Flash Point: 184.7±16.7 °C
Index of Refraction: 1.472
Molar Refractivity: 187.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 37
#Rule of 5 Violations: 2
ACD/LogP: 15.95
ACD/LogD (pH 5.5): 13.87
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 13.87
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 73 Å2
Polarizability: 74.5±0.5 10-24cm3
Surface Tension: 35.3±3.0 dyne/cm
Molar Volume: 670.8±3.0 cm3

Click to predict properties on the Chemicalize site


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