ChemSpider 2D Image | 4-Hydroxy-2,5-bis[2-(3-methyl-2-buten-1-yl)-1H-indol-3-yl]-3,6-dioxo-1,4-cyclohexadien-1-yl acetate | C34H32N2O5

4-Hydroxy-2,5-bis[2-(3-methyl-2-buten-1-yl)-1H-indol-3-yl]-3,6-dioxo-1,4-cyclohexadien-1-yl acetate

  • Molecular FormulaC34H32N2O5
  • Average mass548.628 Da
  • Monoisotopic mass548.231140 Da
  • ChemSpider ID9015660

More details:

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

2,5-Cyclohexadiene-1,4-dione, 2-(acetyloxy)-5-hydroxy-3,6-bis[2-(3-methyl-2-buten-1-yl)-1H-indol-3-yl]- [ACD/Index Name]
4-Hydroxy-2,5-bis[2-(3-methyl-2-buten-1-yl)-1H-indol-3-yl]-3,6-dioxo-1,4-cyclohexadien-1-yl acetate [ACD/IUPAC Name]
4-Hydroxy-2,5-bis[2-(3-methyl-2-buten-1-yl)-1H-indol-3-yl]-3,6-dioxo-1,4-cyclohexadien-1-yl-acetat [German] [ACD/IUPAC Name]
Acétate de 4-hydroxy-2,5-bis[2-(3-méthyl-2-butén-1-yl)-1H-indol-3-yl]-3,6-dioxo-1,4-cyclohexadién-1-yle [French] [ACD/IUPAC Name]
Asterriquinone SU-5500

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

Density: 1.3±0.1 g/cm3
Boiling Point: 809.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 123.4±3.0 kJ/mol
Flash Point: 443.6±34.3 °C
Index of Refraction: 1.685
Molar Refractivity: 157.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 7.27
ACD/LogD (pH 5.5): 3.54
ACD/BCF (pH 5.5): 71.39
ACD/KOC (pH 5.5): 142.08
ACD/LogD (pH 7.4): 2.60
ACD/BCF (pH 7.4): 8.26
ACD/KOC (pH 7.4): 16.45
Polar Surface Area: 112 Å2
Polarizability: 62.5±0.5 10-24cm3
Surface Tension: 65.5±5.0 dyne/cm
Molar Volume: 414.5±5.0 cm3

Click to predict properties on the Chemicalize site


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