ChemSpider 2D Image | evelynin | C19H20O7

evelynin

  • Molecular FormulaC19H20O7
  • Average mass360.358 Da
  • Monoisotopic mass360.120911 Da
  • ChemSpider ID25053323

More details:



Featured data source



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

2,5-Cyclohexadiene-1,4-dione, 2-[3-(3,4-dimethoxyphenyl)-3-oxopropyl]-3,5-dimethoxy- [ACD/Index Name]
2-[3-(3,4-Dimethoxyphenyl)-3-oxopropyl]-3,5-dimethoxy-1,4-benzochinon [German] [ACD/IUPAC Name]
2-[3-(3,4-Dimethoxyphenyl)-3-oxopropyl]-3,5-dimethoxy-1,4-benzoquinone [ACD/IUPAC Name]
2-[3-(3,4-Diméthoxyphényl)-3-oxopropyl]-3,5-diméthoxy-1,4-benzoquinone [French] [ACD/IUPAC Name]
evelynin

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

Density: 1.3±0.1 g/cm3
Boiling Point: 556.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.8±3.0 kJ/mol
Flash Point: 244.9±30.2 °C
Index of Refraction: 1.555
Molar Refractivity: 91.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.67
ACD/LogD (pH 5.5): 2.08
ACD/BCF (pH 5.5): 22.28
ACD/KOC (pH 5.5): 321.02
ACD/LogD (pH 7.4): 2.08
ACD/BCF (pH 7.4): 22.28
ACD/KOC (pH 7.4): 321.02
Polar Surface Area: 88 Å2
Polarizability: 36.2±0.5 10-24cm3
Surface Tension: 48.7±5.0 dyne/cm
Molar Volume: 284.8±5.0 cm3

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