ChemSpider 2D Image | 4,5-Dimethoxy-2-{[(6aS)-1,2,10-trimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-9-yl]oxy}benzaldehyde | C29H31NO7

4,5-Dimethoxy-2-{[(6aS)-1,2,10-trimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-9-yl]oxy}benzaldehyde

  • Molecular FormulaC29H31NO7
  • Average mass505.559 Da
  • Monoisotopic mass505.210052 Da
  • ChemSpider ID68024761

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

4,5-Dimethoxy-2-{[(6aS)-1,2,10-trimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]chinolin-9-yl]oxy}benzaldehyd [German] [ACD/IUPAC Name]
4,5-Diméthoxy-2-{[(6aS)-1,2,10-triméthoxy-6-méthyl-5,6,6a,7-tétrahydro-4H-dibenzo[de,g]quinoléin-9-yl]oxy}benzaldéhyde [French] [ACD/IUPAC Name]
4,5-Dimethoxy-2-{[(6aS)-1,2,10-trimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-9-yl]oxy}benzaldehyde [ACD/IUPAC Name]
Benzaldehyde, 4,5-dimethoxy-2-[[(6aS)-5,6,6a,7-tetrahydro-1,2,10-trimethoxy-6-methyl-4H-dibenzo[de,g]quinolin-9-yl]oxy]- [ACD/Index Name]
10210-99-8 [RN]
4,5-Dimethoxy-2-[[(6aS)-5,6,6a,7-tetrahydro-1,2,10-trimethoxy-6-methyl-4H-dibenzo[de,g]quinolin-9-yl

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

Density: 1.2±0.1 g/cm3
Boiling Point: 639.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.4±3.0 kJ/mol
Flash Point: 340.2±31.5 °C
Index of Refraction: 1.600
Molar Refractivity: 140.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.83
ACD/LogD (pH 5.5): 2.62
ACD/BCF (pH 5.5): 33.50
ACD/KOC (pH 5.5): 224.03
ACD/LogD (pH 7.4): 3.57
ACD/BCF (pH 7.4): 297.89
ACD/KOC (pH 7.4): 1992.25
Polar Surface Area: 76 Å2
Polarizability: 55.8±0.5 10-24cm3
Surface Tension: 46.0±3.0 dyne/cm
Molar Volume: 411.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement