ChemSpider 2D Image | (12R)-1,10,12-Octadecanetriol | C18H38O3

(12R)-1,10,12-Octadecanetriol

  • Molecular FormulaC18H38O3
  • Average mass302.492 Da
  • Monoisotopic mass302.282104 Da
  • ChemSpider ID67498474

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(12R)-1,10,12-Octadecanetriol [ACD/IUPAC Name]
(12R)-1,10,12-Octadécanetriol [French] [ACD/IUPAC Name]
(12R)-1,10,12-Octadecantriol [German] [ACD/IUPAC Name]
1,10,12-Octadecanetriol, (12R)- [ACD/Index Name]
(10rs,12r)-octadecane-1,10,12-triol

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

Density: 0.9±0.1 g/cm3
Boiling Point: 452.3±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 82.1±6.0 kJ/mol
Flash Point: 198.3±15.0 °C
Index of Refraction: 1.476
Molar Refractivity: 90.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 0
ACD/LogP: 4.56
ACD/LogD (pH 5.5): 4.41
ACD/BCF (pH 5.5): 1313.62
ACD/KOC (pH 5.5): 5940.17
ACD/LogD (pH 7.4): 4.41
ACD/BCF (pH 7.4): 1313.62
ACD/KOC (pH 7.4): 5940.17
Polar Surface Area: 61 Å2
Polarizability: 35.7±0.5 10-24cm3
Surface Tension: 38.3±3.0 dyne/cm
Molar Volume: 318.9±3.0 cm3

Click to predict properties on the Chemicalize site


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