ChemSpider 2D Image | N-(2,3-Dimethylphenyl)-3-[(N-palmitoyl-beta-alanyl)amino]benzamide | C34H51N3O3

N-(2,3-Dimethylphenyl)-3-[(N-palmitoyl-β-alanyl)amino]benzamide

  • Molecular FormulaC34H51N3O3
  • Average mass549.787 Da
  • Monoisotopic mass549.393066 Da
  • ChemSpider ID8753955

More details:

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

Benzamide, N-(2,3-dimethylphenyl)-3-[[1-oxo-3-[(1-oxohexadecyl)amino]propyl]amino]- [ACD/Index Name]
N-(2,3-dimethylphenyl)-3-[(N-hexadecanoyl-β-alanyl)amino]benzamide
N-(2,3-Dimethylphenyl)-3-[(N-palmitoyl-β-alanyl)amino]benzamid [German] [ACD/IUPAC Name]
N-(2,3-Dimethylphenyl)-3-[(N-palmitoyl-β-alanyl)amino]benzamide [ACD/IUPAC Name]
N-(2,3-Diméthylphényl)-3-[(N-palmitoyl-β-alanyl)amino]benzamide [French] [ACD/IUPAC Name]
N-(2,3-Dimethyl-phenyl)-3-(3-hexadecanoylamino-propionylamino)-benzamide

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

Density: 1.1±0.1 g/cm3
Boiling Point: 698.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.3±3.0 kJ/mol
Flash Point: 141.6±31.7 °C
Index of Refraction: 1.555
Molar Refractivity: 167.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 2
ACD/LogP: 9.23
ACD/LogD (pH 5.5): 9.32
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 2798293.25
ACD/LogD (pH 7.4): 9.32
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 2798296.25
Polar Surface Area: 87 Å2
Polarizability: 66.3±0.5 10-24cm3
Surface Tension: 43.3±3.0 dyne/cm
Molar Volume: 520.5±3.0 cm3

Click to predict properties on the Chemicalize site


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