ChemSpider 2D Image | (4E)-4-(3-Ethoxy-4-methoxybenzylidene)-2-(2-iodophenyl)-1,3-oxazol-5(4H)-one | C19H16INO4

(4E)-4-(3-Ethoxy-4-methoxybenzylidene)-2-(2-iodophenyl)-1,3-oxazol-5(4H)-one

  • Molecular FormulaC19H16INO4
  • Average mass449.239 Da
  • Monoisotopic mass449.012390 Da
  • ChemSpider ID34431051

  • Double-bond stereo - Double-bond stereo

More details:

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

(4E)-4-(3-Ethoxy-4-methoxybenzyliden)-2-(2-iodphenyl)-1,3-oxazol-5(4H)-on [German] [ACD/IUPAC Name]
(4E)-4-(3-Ethoxy-4-methoxybenzylidene)-2-(2-iodophenyl)-1,3-oxazol-5(4H)-one [ACD/IUPAC Name]
(4E)-4-(3-Éthoxy-4-méthoxybenzylidène)-2-(2-iodophényl)-1,3-oxazol-5(4H)-one [French] [ACD/IUPAC Name]
5(4H)-Oxazolone, 4-[(3-ethoxy-4-methoxyphenyl)methylene]-2-(2-iodophenyl)-, (4E)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 522.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.6±3.0 kJ/mol
Flash Point: 269.8±32.9 °C
Index of Refraction: 1.627
Molar Refractivity: 102.8±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.27
ACD/LogD (pH 5.5): 4.02
ACD/BCF (pH 5.5): 664.35
ACD/KOC (pH 5.5): 3646.47
ACD/LogD (pH 7.4): 4.02
ACD/BCF (pH 7.4): 664.36
ACD/KOC (pH 7.4): 3646.51
Polar Surface Area: 57 Å2
Polarizability: 40.8±0.5 10-24cm3
Surface Tension: 45.6±7.0 dyne/cm
Molar Volume: 290.2±7.0 cm3

Click to predict properties on the Chemicalize site


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