ChemSpider 2D Image | 1-Heptyl-3-stearoyl-1H-indole-2-carboxylic acid | C34H55NO3

1-Heptyl-3-stearoyl-1H-indole-2-carboxylic acid

  • Molecular FormulaC34H55NO3
  • Average mass525.805 Da
  • Monoisotopic mass525.418213 Da
  • ChemSpider ID8705526

More details:






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

1-Heptyl-3-stearoyl-1H-indol-2-carbonsäure [German] [ACD/IUPAC Name]
1-Heptyl-3-stearoyl-1H-indole-2-carboxylic acid [ACD/IUPAC Name]
1H-Indole-2-carboxylic acid, 1-heptyl-3-(1-oxooctadecyl)- [ACD/Index Name]
Acide 1-heptyl-3-stearoyl-1H-indole-2-carboxylique [French] [ACD/IUPAC Name]
1-Heptyl-3-octadecanoyl-1H-indole-2-carboxylic acid

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 653.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.2±3.0 kJ/mol
Flash Point: 349.0±27.3 °C
Index of Refraction: 1.525
Molar Refractivity: 160.3±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 2
ACD/LogP: 12.19
ACD/LogD (pH 5.5): 10.87
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 4157462.00
ACD/LogD (pH 7.4): 9.40
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 141247.42
Polar Surface Area: 59 Å2
Polarizability: 63.5±0.5 10-24cm3
Surface Tension: 37.4±7.0 dyne/cm
Molar Volume: 523.1±7.0 cm3

Click to predict properties on the Chemicalize site






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