ChemSpider 2D Image | aulicine | C18H25NO4

aulicine

  • Molecular FormulaC18H25NO4
  • Average mass319.395 Da
  • Monoisotopic mass319.178345 Da
  • ChemSpider ID29355830
  • defined stereocentres - 3 of 3 defined stereocentres


More details:



Featured data source



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

(1R,10R,12R)-4,5,12-Trimethoxy-9-azatetracyclo[7.5.2.01,10.02,7]hexadeca-2,4,6-trien-3-ol [German] [ACD/IUPAC Name]
(1R,10R,12R)-4,5,12-Trimethoxy-9-azatetracyclo[7.5.2.01,10.02,7]hexadeca-2,4,6-trien-3-ol [ACD/IUPAC Name]
(1R,10R,12R)-4,5,12-Triméthoxy-9-azatétracyclo[7.5.2.01,10.02,7]hexadéca-2,4,6-trién-3-ol [French] [ACD/IUPAC Name]
1H,6H-5,10b-Ethanophenanthridin-10-ol, 2,3,4,4a-tetrahydro-3,8,9-trimethoxy-, (3R,4aR,10bR)- [ACD/Index Name]
aulicine
66276-51-5 [RN]
Hippeastidine

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 457.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.5±3.0 kJ/mol
Flash Point: 230.2±28.7 °C
Index of Refraction: 1.603
Molar Refractivity: 86.8±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.41
ACD/LogD (pH 5.5): 0.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.22
ACD/LogD (pH 7.4): 1.45
ACD/BCF (pH 7.4): 6.60
ACD/KOC (pH 7.4): 117.15
Polar Surface Area: 51 Å2
Polarizability: 34.4±0.5 10-24cm3
Surface Tension: 54.3±5.0 dyne/cm
Molar Volume: 252.5±5.0 cm3

Click to predict properties on the Chemicalize site






Advertisement