ChemSpider 2D Image | 8-Methyl-8,15-diazahexacyclo[14.2.1.0~1,9~.0~2,7~.0~10,15~.0~12,17~]nonadeca-2,4,6-triene-14,18-diol | C18H22N2O2

8-Methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-triene-14,18-diol

  • Molecular FormulaC18H22N2O2
  • Average mass298.379 Da
  • Monoisotopic mass298.168121 Da
  • ChemSpider ID21542327

More details:






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

5H-6,10:11,12a-Dimethanoindolo[3,2-b]quinolizine-8,13-diol, 5a,6,8,9,10,11,11a,12-octahydro-5-methyl- [ACD/Index Name]
8-Methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-trien-14,18-diol [German] [ACD/IUPAC Name]
8-Methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-triene-14,18-diol [ACD/IUPAC Name]
8-Méthyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadéca-2,4,6-triène-14,18-diol [French] [ACD/IUPAC Name]
AJM

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 511.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.4±3.0 kJ/mol
Flash Point: 293.9±28.8 °C
Index of Refraction: 1.742
Molar Refractivity: 82.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.24
ACD/LogD (pH 5.5): -1.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.31
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 17.36
Polar Surface Area: 47 Å2
Polarizability: 32.8±0.5 10-24cm3
Surface Tension: 75.6±5.0 dyne/cm
Molar Volume: 204.8±5.0 cm3

Click to predict properties on the Chemicalize site






Advertisement