ChemSpider 2D Image | (14aS)-2,3,6,7-Tetramethoxy-11,12,13,14,14a,15-hexahydro-9H-dibenzo[f,h]pyrido[1,2-b]isoquinoline | C25H29NO4

(14aS)-2,3,6,7-Tetramethoxy-11,12,13,14,14a,15-hexahydro-9H-dibenzo[f,h]pyrido[1,2-b]isoquinoline

  • Molecular FormulaC25H29NO4
  • Average mass407.502 Da
  • Monoisotopic mass407.209656 Da
  • ChemSpider ID28493946

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(14aS)-2,3,6,7-Tetramethoxy-11,12,13,14,14a,15-hexahydro-9H-dibenzo[f,h]pyrido[1,2-b]isochinolin [German] [ACD/IUPAC Name]
(14aS)-2,3,6,7-Tétraméthoxy-11,12,13,14,14a,15-hexahydro-9H-dibenzo[f,h]pyrido[1,2-b]isoquinoléine [French] [ACD/IUPAC Name]
(14aS)-2,3,6,7-Tetramethoxy-11,12,13,14,14a,15-hexahydro-9H-dibenzo[f,h]pyrido[1,2-b]isoquinoline [ACD/IUPAC Name]
9H-Phenanthro[9,10-b]quinolizine, 11,12,13,14,14a,15-hexahydro-2,3,6,7-tetramethoxy-, (14aS)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 570.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.6±3.0 kJ/mol
Flash Point: 161.5±25.9 °C
Index of Refraction: 1.648
Molar Refractivity: 119.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.19
ACD/LogD (pH 5.5): 2.59
ACD/BCF (pH 5.5): 17.17
ACD/KOC (pH 5.5): 68.01
ACD/LogD (pH 7.4): 4.24
ACD/BCF (pH 7.4): 780.30
ACD/KOC (pH 7.4): 3091.27
Polar Surface Area: 40 Å2
Polarizability: 47.4±0.5 10-24cm3
Surface Tension: 54.5±5.0 dyne/cm
Molar Volume: 328.3±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement