ChemSpider 2D Image | ADBICA-d9 | C20H20D9N3O2

ADBICA-d9

  • Molecular FormulaC20H20D9N3O2
  • Average mass352.519 Da
  • Monoisotopic mass352.282471 Da
  • ChemSpider ID30646763

  • Non-standard isotope - Non-standard isotope

More details:

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

1H-Indole-3-carboxamide, N-[1-(aminocarbonyl)-2,2-dimethylpropyl]-1-(pentyl-2,2,3,3,4,4,5,5,5-d9)- [ACD/Index Name]
ADBICA-d9
N-(1-Amino-3,3-dimethyl-1-oxo-2-butanyl)-1-[(2,2,3,3,4,4,5,5,5-2H9)pentyl]-1H-indol-3-carboxamid [German] [ACD/IUPAC Name]
N-(1-Amino-3,3-dimethyl-1-oxo-2-butanyl)-1-[(2,2,3,3,4,4,5,5,5-2H9)pentyl]-1H-indole-3-carboxamide [ACD/IUPAC Name]
N-(1-Amino-3,3-diméthyl-1-oxo-2-butanyl)-1-[(2,2,3,3,4,4,5,5,5-2H9)pentyl]-1H-indole-3-carboxamide [French] [ACD/IUPAC Name]
2747914-01-6 [RN]
N-(1-amino-3,3-dimethyl-1-oxobutan-2-yl)-1-(pentyl-2,2',3,3',4,4',5,5,5-d9)-1H-indole-3-carboxamide

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

Density: 1.1±0.1 g/cm3
Boiling Point: 595.0±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.7±3.0 kJ/mol
Flash Point: 313.7±24.6 °C
Index of Refraction: 1.567
Molar Refractivity: 100.0±0.5 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.16
ACD/LogD (pH 5.5): 4.28
ACD/BCF (pH 5.5): 1061.19
ACD/KOC (pH 5.5): 5098.75
ACD/LogD (pH 7.4): 4.28
ACD/BCF (pH 7.4): 1061.19
ACD/KOC (pH 7.4): 5098.74
Polar Surface Area: 77 Å2
Polarizability: 39.7±0.5 10-24cm3
Surface Tension: 40.9±7.0 dyne/cm
Molar Volume: 306.2±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement