ChemSpider 2D Image | (2E)-2-(2-Hydroxy-3,5-diiodobenzylidene)-5,6-dimethoxy-1-indanone | C18H14I2O4

(2E)-2-(2-Hydroxy-3,5-diiodobenzylidene)-5,6-dimethoxy-1-indanone

  • Molecular FormulaC18H14I2O4
  • Average mass548.110 Da
  • Monoisotopic mass547.898132 Da
  • ChemSpider ID19405656

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-2-(2-Hydroxy-3,5-diiodbenzyliden)-5,6-dimethoxy-1-indanon [German] [ACD/IUPAC Name]
(2E)-2-(2-Hydroxy-3,5-diiodobenzylidene)-5,6-dimethoxy-1-indanone [ACD/IUPAC Name]
(2E)-2-(2-Hydroxy-3,5-diiodobenzylidène)-5,6-diméthoxy-1-indanone [French] [ACD/IUPAC Name]
(2E)-2-(2-hydroxy-3,5-diiodobenzylidene)-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one
1H-Inden-1-one, 2,3-dihydro-2-[(2-hydroxy-3,5-diiodophenyl)methylene]-5,6-dimethoxy-, (2E)- [ACD/Index Name]
2-[1-(2-Hydroxy-3,5-diiodo-phenyl)-meth-(E)-ylidene]-5,6-dimethoxy-indan-1-one

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

Density: 2.0±0.1 g/cm3
Boiling Point: 597.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.2±3.0 kJ/mol
Flash Point: 314.9±30.1 °C
Index of Refraction: 1.740
Molar Refractivity: 110.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: 6.27
ACD/LogD (pH 5.5): 5.46
ACD/BCF (pH 5.5): 8183.81
ACD/KOC (pH 5.5): 21791.78
ACD/LogD (pH 7.4): 4.90
ACD/BCF (pH 7.4): 2264.79
ACD/KOC (pH 7.4): 6030.65
Polar Surface Area: 56 Å2
Polarizability: 43.7±0.5 10-24cm3
Surface Tension: 64.9±3.0 dyne/cm
Molar Volume: 273.4±3.0 cm3

Click to predict properties on the Chemicalize site


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