ChemSpider 2D Image | 16-Hydroxy-3,15-dimethoxy-1,3,4,6-tetradehydroerythrinan-2-one | C18H19NO4

16-Hydroxy-3,15-dimethoxy-1,3,4,6-tetradehydroerythrinan-2-one

  • Molecular FormulaC18H19NO4
  • Average mass313.348 Da
  • Monoisotopic mass313.131409 Da
  • ChemSpider ID74174422

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

16-Hydroxy-3,15-dimethoxy-1,3,4,6-tetradehydroerythrinan-2-on [German] [ACD/IUPAC Name]
16-Hydroxy-3,15-dimethoxy-1,3,4,6-tetradehydroerythrinan-2-one [ACD/IUPAC Name]
16-Hydroxy-3,15-diméthoxy-1,3,4,6-tétradéhydroerythrinan-2-one [French] [ACD/IUPAC Name]
3H-Indolo[7a,1-a]isoquinolin-3-one, 5,6,8,9-tetrahydro-11-hydroxy-2,12-dimethoxy-, (13aS)-
5531-67-9 [RN]
Erythrinan-2-one, 1,3,4,6-tetradehydro-16-hydroxy-3,15-dimethoxy- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 558.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.2±3.0 kJ/mol
Flash Point: 291.8±30.1 °C
Index of Refraction: 1.661
Molar Refractivity: 84.6±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.17
ACD/LogD (pH 5.5): 2.26
ACD/BCF (pH 5.5): 30.42
ACD/KOC (pH 5.5): 399.57
ACD/LogD (pH 7.4): 2.26
ACD/BCF (pH 7.4): 30.71
ACD/KOC (pH 7.4): 403.28
Polar Surface Area: 59 Å2
Polarizability: 33.5±0.5 10-24cm3
Surface Tension: 62.6±5.0 dyne/cm
Molar Volume: 228.9±5.0 cm3

Click to predict properties on the Chemicalize site


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