ChemSpider 2D Image | 5-Hydroxy-2,11,16-trioxopicrasa-3,14-diene-1,12,20-triyl triacetate | C26H30O11

5-Hydroxy-2,11,16-trioxopicrasa-3,14-diene-1,12,20-triyl triacetate

  • Molecular FormulaC26H30O11
  • Average mass518.510 Da
  • Monoisotopic mass518.178833 Da
  • ChemSpider ID383091

More details:

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

5-Hydroxy-2,11,16-trioxopicrasa-3,14-dien-1,12,20-triyl-triacetat [German] [ACD/IUPAC Name]
5-Hydroxy-2,11,16-trioxopicrasa-3,14-diene-1,12,20-triyl triacetate [ACD/IUPAC Name]
Picrasa-3,14-diene-2,11,16-trione, 1,12,20-tris(acetyloxy)-5-hydroxy- [ACD/Index Name]
Triacétate de 5-hydroxy-2,11,16-trioxopicrasa-3,14-diène-1,12,20-triyle [French] [ACD/IUPAC Name]
5-Hydroxy-δ14,15-chaparrinone triacetate
79802-82-7 [RN]
CHAPARRINONE TRIACETATE, 5-HYDROXY-14,15-DEHYDRO

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

NSC324630 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 680.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 114.2±6.0 kJ/mol
Flash Point: 225.5±25.0 °C
Index of Refraction: 1.573
Molar Refractivity: 122.7±0.4 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 0.60
ACD/LogD (pH 5.5): 1.21
ACD/BCF (pH 5.5): 4.89
ACD/KOC (pH 5.5): 108.40
ACD/LogD (pH 7.4): 1.21
ACD/BCF (pH 7.4): 4.89
ACD/KOC (pH 7.4): 108.39
Polar Surface Area: 160 Å2
Polarizability: 48.7±0.5 10-24cm3
Surface Tension: 58.4±5.0 dyne/cm
Molar Volume: 372.4±5.0 cm3

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