ChemSpider 2D Image | (2S)-1-Hydroxy-3-(octadecyloxy)-2-propanyl acetate | C23H46O4

(2S)-1-Hydroxy-3-(octadecyloxy)-2-propanyl acetate

  • Molecular FormulaC23H46O4
  • Average mass386.609 Da
  • Monoisotopic mass386.339600 Da
  • ChemSpider ID18558312

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-1-Hydroxy-3-(octadecyloxy)-2-propanyl acetate [ACD/IUPAC Name]
(2S)-1-Hydroxy-3-(octadecyloxy)-2-propanyl-acetat [German] [ACD/IUPAC Name]
1,2-Propanediol, 3-(octadecyloxy)-, 2-acetate, (2S)- [ACD/Index Name]
Acétate de (2S)-1-hydroxy-3-(octadécyloxy)-2-propanyle [French] [ACD/IUPAC Name]
(2S)-1-hydroxy-3-(octadecyloxy)propan-2-yl acetate
2-Acetyl-1-octadecyl-sn-glycerol
DG(18:0e/2:0/0:0)
DG(O-18:0/2:0/0:0)

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: 484.0±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 86.3±6.0 kJ/mol
Flash Point: 149.3±16.7 °C
Index of Refraction: 1.459
Molar Refractivity: 113.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 22
#Rule of 5 Violations: 1
ACD/LogP: 8.59
ACD/LogD (pH 5.5): 8.43
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 923183.75
ACD/LogD (pH 7.4): 8.43
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 923183.75
Polar Surface Area: 56 Å2
Polarizability: 45.0±0.5 10-24cm3
Surface Tension: 34.2±3.0 dyne/cm
Molar Volume: 415.9±3.0 cm3

Click to predict properties on the Chemicalize site


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