ChemSpider 2D Image | 1-(5-Benzyl-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)-1-decanone | C28H36N2O

1-(5-Benzyl-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)-1-decanone

  • Molecular FormulaC28H36N2O
  • Average mass416.598 Da
  • Monoisotopic mass416.282776 Da
  • ChemSpider ID22797790

More details:

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

1-(5-Benzyl-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)-1-decanon [German] [ACD/IUPAC Name]
1-(5-Benzyl-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)-1-decanone [ACD/IUPAC Name]
1-(5-Benzyl-1,3,4,5-tétrahydro-2H-pyrido[4,3-b]indol-2-yl)-1-décanone [French] [ACD/IUPAC Name]
1-Decanone, 1-[1,3,4,5-tetrahydro-5-(phenylmethyl)-2H-pyrido[4,3-b]indol-2-yl]- [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: 618.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.7±3.0 kJ/mol
Flash Point: 327.7±31.5 °C
Index of Refraction: 1.587
Molar Refractivity: 130.0±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 7.89
ACD/LogD (pH 5.5): 8.74
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1355631.25
ACD/LogD (pH 7.4): 8.74
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1355632.75
Polar Surface Area: 25 Å2
Polarizability: 51.5±0.5 10-24cm3
Surface Tension: 41.6±7.0 dyne/cm
Molar Volume: 386.9±7.0 cm3

Click to predict properties on the Chemicalize site


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