ChemSpider 2D Image | 5-Methoxy-1-methyl-4,9-dihydro-3H-beta-carboline | C13H14N2O

5-Methoxy-1-methyl-4,9-dihydro-3H-β-carboline

  • Molecular FormulaC13H14N2O
  • Average mass214.263 Da
  • Monoisotopic mass214.110611 Da
  • ChemSpider ID62968019

More details:

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

3H-Pyrido[3,4-b]indole, 4,9-dihydro-5-methoxy-1-methyl- [ACD/Index Name]
5-Methoxy-1-methyl-4,9-dihydro-3H-β-carbolin [German] [ACD/IUPAC Name]
5-Methoxy-1-methyl-4,9-dihydro-3H-β-carboline [ACD/IUPAC Name]
5-Méthoxy-1-méthyl-4,9-dihydro-3H-β-carboline [French] [ACD/IUPAC Name]
109021-56-9 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 392.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 61.7±3.0 kJ/mol
Flash Point: 191.0±27.9 °C
Index of Refraction: 1.647
Molar Refractivity: 61.9±0.5 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.08
ACD/LogD (pH 5.5): 0.93
ACD/BCF (pH 5.5): 1.32
ACD/KOC (pH 5.5): 15.95
ACD/LogD (pH 7.4): 2.24
ACD/BCF (pH 7.4): 26.70
ACD/KOC (pH 7.4): 322.76
Polar Surface Area: 37 Å2
Polarizability: 24.6±0.5 10-24cm3
Surface Tension: 42.6±7.0 dyne/cm
Molar Volume: 170.5±7.0 cm3

Click to predict properties on the Chemicalize site


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