ChemSpider 2D Image | (6aS)-1,11-Dihydroxy-2,10-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolinium | C19H22NO4

(6aS)-1,11-Dihydroxy-2,10-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolinium

  • Molecular FormulaC19H22NO4
  • Average mass328.382 Da
  • Monoisotopic mass328.154327 Da
  • ChemSpider ID128920809

  • Charge - Charge

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(6aS)-1,11-Dihydroxy-2,10-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]chinolinium [German] [ACD/IUPAC Name]
(6aS)-1,11-Dihydroxy-2,10-diméthoxy-6-méthyl-5,6,6a,7-tétrahydro-4H-dibenzo[de,g]quinoléinium [French] [ACD/IUPAC Name]
(6aS)-1,11-Dihydroxy-2,10-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolinium [ACD/IUPAC Name]
4H-Dibenzo[de,g]quinoline-1,11-diol, 5,6,6a,7-tetrahydro-2,10-dimethoxy-6-methyl-, conjugate acid, (6aS)- [ACD/Index Name]
(6aS)-2,10-Dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-1,11-diol [ACD/IUPAC Name]
(S)-corytuberine

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

Density:
Boiling Point: 529.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.5±3.0 kJ/mol
Flash Point: 273.9±30.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.32
ACD/LogD (pH 5.5): 1.18
ACD/BCF (pH 5.5): 2.04
ACD/KOC (pH 5.5): 22.08
ACD/LogD (pH 7.4): 2.50
ACD/BCF (pH 7.4): 43.13
ACD/KOC (pH 7.4): 466.07
Polar Surface Area: 63 Å2
Polarizability:
Surface Tension:
Molar Volume:

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