ChemSpider 2D Image | (5beta,8alpha,10alpha)-2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione | C22H28O6

(5β,8α,10α)-2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione

  • Molecular FormulaC22H28O6
  • Average mass388.454 Da
  • Monoisotopic mass388.188599 Da
  • ChemSpider ID82965265

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(5β,8α,10α)-2,12-Dimethoxypicrasa-2,12-dien-1,11,16-trion [German] [ACD/IUPAC Name]
(5β,8α,10α)-2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione [ACD/IUPAC Name]
(5β,8α,10α)-2,12-Diméthoxypicrasa-2,12-diène-1,11,16-trione [French] [ACD/IUPAC Name]
Picrasa-2,12-diene-1,11,16-trione, 2,12-dimethoxy-, (5β,8α,10α)- [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: 586.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.6±3.0 kJ/mol
Flash Point: 255.4±30.2 °C
Index of Refraction: 1.553
Molar Refractivity: 100.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.22
ACD/LogD (pH 5.5): 2.78
ACD/BCF (pH 5.5): 76.75
ACD/KOC (pH 5.5): 777.94
ACD/LogD (pH 7.4): 2.78
ACD/BCF (pH 7.4): 76.75
ACD/KOC (pH 7.4): 777.94
Polar Surface Area: 79 Å2
Polarizability: 39.8±0.5 10-24cm3
Surface Tension: 45.8±5.0 dyne/cm
Molar Volume: 313.8±5.0 cm3

Click to predict properties on the Chemicalize site


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