ChemSpider 2D Image | 2-(Benzyloxy)-3-[(2-methyloctadecyl)oxy]-1-propanol | C29H52O3

2-(Benzyloxy)-3-[(2-methyloctadecyl)oxy]-1-propanol

  • Molecular FormulaC29H52O3
  • Average mass448.721 Da
  • Monoisotopic mass448.391632 Da
  • ChemSpider ID28683736

More details:

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

1-Propanol, 3-[(2-methyloctadecyl)oxy]-2-(phenylmethoxy)- [ACD/Index Name]
2-(Benzyloxy)-3-[(2-methyloctadecyl)oxy]-1-propanol [German] [ACD/IUPAC Name]
2-(Benzyloxy)-3-[(2-methyloctadecyl)oxy]-1-propanol [ACD/IUPAC Name]
2-(Benzyloxy)-3-[(2-méthyloctadécyl)oxy]-1-propanol [French] [ACD/IUPAC Name]
138852-21-8 [RN]
2-(BENZYLOXY)-3-[(2-METHYLOCTADECYL)OXY]PROPAN-1-OL

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

Density: 0.9±0.1 g/cm3
Boiling Point: 550.4±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.4±3.0 kJ/mol
Flash Point: 286.7±25.9 °C
Index of Refraction: 1.487
Molar Refractivity: 138.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 23
#Rule of 5 Violations: 1
ACD/LogP: 10.89
ACD/LogD (pH 5.5): 10.27
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 9231453.00
ACD/LogD (pH 7.4): 10.27
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 9231453.00
Polar Surface Area: 39 Å2
Polarizability: 54.7±0.5 10-24cm3
Surface Tension: 35.4±3.0 dyne/cm
Molar Volume: 479.9±3.0 cm3

Click to predict properties on the Chemicalize site


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