ChemSpider 2D Image | Methyl N-[(4-hexylcyclohexyl)carbonyl]tryptophylvalinate | C30H45N3O4

Methyl N-[(4-hexylcyclohexyl)carbonyl]tryptophylvalinate

  • Molecular FormulaC30H45N3O4
  • Average mass511.696 Da
  • Monoisotopic mass511.341003 Da
  • ChemSpider ID22494884

More details:

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

Methyl N-[(4-hexylcyclohexyl)carbonyl]tryptophylvalinate [ACD/IUPAC Name]
MethylN-[(4-hexylcyclohexyl)carbonyl]tryptophylvalinat [German] [ACD/IUPAC Name]
N-[(4-Hexylcyclohexyl)carbonyl]tryptophylvalinate de méthyle [French] [ACD/IUPAC Name]
Valine, N-[(4-hexylcyclohexyl)carbonyl]tryptophyl-, methyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 735.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.2±3.0 kJ/mol
Flash Point: 398.3±32.9 °C
Index of Refraction: 1.546
Molar Refractivity: 147.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 7.29
ACD/LogD (pH 5.5): 6.96
ACD/BCF (pH 5.5): 114814.59
ACD/KOC (pH 5.5): 145721.67
ACD/LogD (pH 7.4): 6.96
ACD/BCF (pH 7.4): 114814.46
ACD/KOC (pH 7.4): 145721.52
Polar Surface Area: 100 Å2
Polarizability: 58.4±0.5 10-24cm3
Surface Tension: 44.6±3.0 dyne/cm
Molar Volume: 465.9±3.0 cm3

Click to predict properties on the Chemicalize site


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