ChemSpider 2D Image | GLYCERYL 1-TARTRATE 2,3-DISTEARATE | C43H80O10

GLYCERYL 1-TARTRATE 2,3-DISTEARATE

  • Molecular FormulaC43H80O10
  • Average mass757.089 Da
  • Monoisotopic mass756.575134 Da
  • ChemSpider ID32699049

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

(2R,3R)-4-[2,3-Bis(stearoyloxy)propoxy]-2,3-dihydroxy-4-oxobutanoic acid [ACD/IUPAC Name]
(2R,3R)-4-[2,3-Bis(stearoyloxy)propoxy]-2,3-dihydroxy-4-oxobutansäure [German] [ACD/IUPAC Name]
14711-99-0 [RN]
Acide (2R,3R)-4-[2,3-bis(stearoyloxy)propoxy]-2,3-dihydroxy-4-oxobutanoïque [French] [ACD/IUPAC Name]
Butanedioic acid, 2,3-dihydroxy-, mono[2,3-bis[(1-oxooctadecyl)oxy]propyl] ester, (2R,3R)- [ACD/Index Name]
GLYCERYL 1-TARTRATE 2,3-DISTEARATE

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

A1TEB5S4MG [DBID]
UNII:A1TEB5S4MG [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: 772.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.0 mmHg at 25°C
Enthalpy of Vaporization: 128.2±6.0 kJ/mol
Flash Point: 211.2±26.4 °C
Index of Refraction: 1.483
Molar Refractivity: 211.1±0.3 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 43
#Rule of 5 Violations: 3
ACD/LogP: 15.19
ACD/LogD (pH 5.5): 11.05
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1198239.63
ACD/LogD (pH 7.4): 10.21
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 172588.33
Polar Surface Area: 157 Å2
Polarizability: 83.7±0.5 10-24cm3
Surface Tension: 40.4±3.0 dyne/cm
Molar Volume: 739.5±3.0 cm3

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