ChemSpider 2D Image | 1,2-DISTEAROYL-SN-GLYCERO-3-(PHOSPHO-RAC-(1-GLYCEROL)) | C42H83O10P

1,2-DISTEAROYL-SN-GLYCERO-3-(PHOSPHO-RAC-(1-GLYCEROL))

  • Molecular FormulaC42H83O10P
  • Average mass779.076 Da
  • Monoisotopic mass778.572388 Da
  • ChemSpider ID10020703

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(2R)-3-{[(2,3-Dihydroxypropoxy)(hydroxy)phosphoryl]oxy}-2-(stearoyloxy)propyl stearate [ACD/IUPAC Name]
(2R)-3-{[(2,3-Dihydroxypropoxy)(hydroxy)phosphoryl]oxy}-2-(stearoyloxy)propylstearat [German] [ACD/IUPAC Name]
1,2-DISTEAROYL-SN-GLYCERO-3-(PHOSPHO-RAC-(1-GLYCEROL))
217939-97-4 [RN]
Octadecanoic acid, (1R)-1-[[[(2,3-dihydroxypropoxy)hydroxyphosphinyl]oxy]methyl]-1,2-ethanediyl ester [ACD/Index Name]
Stéarate de (2R)-3-{[(2,3-dihydroxypropoxy)(hydroxy)phosphoryl]oxy}-2-(stearoyloxy)propyle [French] [ACD/IUPAC Name]
1,2-Distearoyl-sn-glycero-3-phospho-(1'-sn-glycerol)
Phosphatidylglycerol

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

UNII:Z16Y0357CV [DBID]
Z16Y0357CV [DBID]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 796.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.3 mmHg at 25°C
Enthalpy of Vaporization: 131.9±6.0 kJ/mol
Flash Point: 435.4±35.7 °C
Index of Refraction: 1.479
Molar Refractivity: 215.1±0.3 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 44
#Rule of 5 Violations: 3
ACD/LogP: 15.15
ACD/LogD (pH 5.5): 10.01
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 180795.39
ACD/LogD (pH 7.4): 9.93
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 152905.45
Polar Surface Area: 159 Å2
Polarizability: 85.3±0.5 10-24cm3
Surface Tension: 40.0±3.0 dyne/cm
Molar Volume: 758.9±3.0 cm3

Click to predict properties on the Chemicalize site


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