ChemSpider 2D Image | 18-(~2~H_3_)Methylicosanoic acid | C21H39D3O2

18-(2H3)Methylicosanoic acid

  • Molecular FormulaC21H39D3O2
  • Average mass329.576 Da
  • Monoisotopic mass329.337311 Da
  • ChemSpider ID30773410

  • Non-standard isotope - Non-standard isotope

More details:

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

18-(2H3)Methylicosanoic acid [ACD/IUPAC Name]
18-(2H3)Methylicosansäure [German] [ACD/IUPAC Name]
Acide 18-(2H3)méthylicosanoïque [French] [ACD/IUPAC Name]
Eicosanoic acid, 18-(methyl-d3)- [ACD/Index Name]
(?)-18-Methyl-d3-eicosanoic Acid
(±)-18-Methyl-d3-eicosanoic Acid
18-Methylarachidic Acid, Anteisoheneicosanoic Acid

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

Density: 0.9±0.1 g/cm3
Boiling Point: 443.2±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 76.8±6.0 kJ/mol
Flash Point: 251.2±8.2 °C
Index of Refraction: 1.457
Molar Refractivity: 100.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 1
ACD/LogP: 9.63
ACD/LogD (pH 5.5): 7.66
ACD/BCF (pH 5.5): 251295.73
ACD/KOC (pH 5.5): 151619.19
ACD/LogD (pH 7.4): 5.86
ACD/BCF (pH 7.4): 4031.41
ACD/KOC (pH 7.4): 2432.35
Polar Surface Area: 37 Å2
Polarizability: 40.0±0.5 10-24cm3
Surface Tension: 32.9±3.0 dyne/cm
Molar Volume: 370.2±3.0 cm3

Click to predict properties on the Chemicalize site


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