ChemSpider 2D Image | (13aS)-2,3,10-Trimethoxy-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinolin-11-ol | C20H23NO4

(13aS)-2,3,10-Trimethoxy-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinolin-11-ol

  • Molecular FormulaC20H23NO4
  • Average mass341.401 Da
  • Monoisotopic mass341.162720 Da
  • ChemSpider ID28287938

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

Featured data source
Natural Product Updates

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

(13aS)-2,3,10-Trimethoxy-5,8,13,13a-tetrahydro-6H-isochinolino[3,2-a]isochinolin-11-ol [German] [ACD/IUPAC Name]
(13aS)-2,3,10-Triméthoxy-5,8,13,13a-tétrahydro-6H-isoquinoléino[3,2-a]isoquinoléin-11-ol [French] [ACD/IUPAC Name]
(13aS)-2,3,10-Trimethoxy-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinolin-11-ol [ACD/IUPAC Name]
6H-Dibenzo[a,g]quinolizin-11-ol, 5,8,13,13a-tetrahydro-2,3,10-trimethoxy-, (13aS)- [ACD/Index Name]
(S)-corytenchine
(S)-Tetrahydropalmatrubine
18090-68-1 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 493.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.0±3.0 kJ/mol
Flash Point: 252.5±28.7 °C
Index of Refraction: 1.640
Molar Refractivity: 95.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.93
ACD/LogD (pH 5.5): 2.06
ACD/BCF (pH 5.5): 11.40
ACD/KOC (pH 5.5): 93.84
ACD/LogD (pH 7.4): 3.13
ACD/BCF (pH 7.4): 136.35
ACD/KOC (pH 7.4): 1122.42
Polar Surface Area: 51 Å2
Polarizability: 37.7±0.5 10-24cm3
Surface Tension: 59.0±5.0 dyne/cm
Molar Volume: 263.6±5.0 cm3

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