ChemSpider 2D Image | 16-Hydroxy-2,12-dimethoxypicrasa-2,12-diene-1,11-dione | C22H30O6

16-Hydroxy-2,12-dimethoxypicrasa-2,12-diene-1,11-dione

  • Molecular FormulaC22H30O6
  • Average mass390.470 Da
  • Monoisotopic mass390.204254 Da
  • ChemSpider ID25016338

  • defined stereocentres - 7 of 8 defined stereocentres

More details:

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

16-Hydroxy-2,12-dimethoxypicrasa-2,12-dien-1,11-dion [German] [ACD/IUPAC Name]
16-Hydroxy-2,12-dimethoxypicrasa-2,12-diene-1,11-dione [ACD/IUPAC Name]
16-Hydroxy-2,12-diméthoxypicrasa-2,12-diène-1,11-dione [French] [ACD/IUPAC Name]
Picrasa-2,12-diene-1,11-dione, 16-hydroxy-2,12-dimethoxy- [ACD/Index Name]
Neoquassin

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

Density: 1.2±0.1 g/cm3
Boiling Point: 567.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.5 mmHg at 25°C
Enthalpy of Vaporization: 97.9±6.0 kJ/mol
Flash Point: 195.5±23.6 °C
Index of Refraction: 1.560
Molar Refractivity: 101.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.59
ACD/LogD (pH 5.5): 2.19
ACD/BCF (pH 5.5): 27.31
ACD/KOC (pH 5.5): 371.26
ACD/LogD (pH 7.4): 2.19
ACD/BCF (pH 7.4): 27.30
ACD/KOC (pH 7.4): 371.25
Polar Surface Area: 82 Å2
Polarizability: 40.3±0.5 10-24cm3
Surface Tension: 47.4±5.0 dyne/cm
Molar Volume: 314.9±5.0 cm3

Click to predict properties on the Chemicalize site


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