ChemSpider 2D Image | 1-Methyl-9-(~2~H_3_)methyl-7-[(~2~H_3_)methyloxy]-9H-beta-carboline | C14H8D6N2O

1-Methyl-9-(2H3)methyl-7-[(2H3)methyloxy]-9H-β-carboline

  • Molecular FormulaC14H8D6N2O
  • Average mass232.311 Da
  • Monoisotopic mass232.148270 Da
  • ChemSpider ID58779951

  • Non-standard isotope - Non-standard isotope

More details:

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

1-Methyl-9-(2H3)methyl-7-[(2H3)methyloxy]-9H-β-carbolin [German] [ACD/IUPAC Name]
1-Methyl-9-(2H3)methyl-7-[(2H3)methyloxy]-9H-β-carboline [ACD/IUPAC Name]
1-Méthyl-9-(2H3)méthyl-7-[(2H3)méthyloxy]-9H-β-carboline [French] [ACD/IUPAC Name]
9H-Pyrido[3,4-b]indole, 1-methyl-9-(methyl-d3)-7-(methyl-d3-oxy)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 405.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.7±3.0 kJ/mol
Flash Point: 198.8±28.7 °C
Index of Refraction: 1.619
Molar Refractivity: 67.3±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.92
ACD/LogD (pH 5.5): 0.67
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.14
ACD/LogD (pH 7.4): 1.51
ACD/BCF (pH 7.4): 3.39
ACD/KOC (pH 7.4): 28.91
Polar Surface Area: 27 Å2
Polarizability: 26.7±0.5 10-24cm3
Surface Tension: 39.5±7.0 dyne/cm
Molar Volume: 191.8±7.0 cm3

Click to predict properties on the Chemicalize site


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