ChemSpider 2D Image | 6-Ethoxy-1-[3-methoxy-4-(2-phenylethoxy)phenyl]-2,3,4,9-tetrahydro-1H-beta-carbolin-2-ium | C28H31N2O3

6-Ethoxy-1-[3-methoxy-4-(2-phenylethoxy)phenyl]-2,3,4,9-tetrahydro-1H-β-carbolin-2-ium

  • Molecular FormulaC28H31N2O3
  • Average mass443.557 Da
  • Monoisotopic mass443.232910 Da
  • ChemSpider ID21209638

  • Charge - Charge

More details:

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

1H-Pyrido[3,4-b]indolium, 6-ethoxy-2,3,4,9-tetrahydro-1-[3-methoxy-4-(2-phenylethoxy)phenyl]- [ACD/Index Name]
6-Ethoxy-1-[3-methoxy-4-(2-phenylethoxy)phenyl]-2,3,4,9-tetrahydro-1H-β-carbolin-2-ium [ACD/IUPAC Name]
6-Ethoxy-1-[3-methoxy-4-(2-phenylethoxy)phenyl]-2,3,4,9-tetrahydro-1H-β-carbolin-2-ium [German] [ACD/IUPAC Name]
6-Éthoxy-1-[3-méthoxy-4-(2-phényléthoxy)phényl]-2,3,4,9-tétrahydro-1H-β-carbolin-2-ium [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 635.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.8±3.0 kJ/mol
Flash Point: 337.8±31.5 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.67
ACD/LogD (pH 5.5): 2.02
ACD/BCF (pH 5.5): 3.79
ACD/KOC (pH 5.5): 12.41
ACD/LogD (pH 7.4): 3.11
ACD/BCF (pH 7.4): 46.67
ACD/KOC (pH 7.4): 153.03
Polar Surface Area: 60 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


Advertisement