ChemSpider 2D Image | 2-Ethoxyethyl (2Z)-2-cyano-3-(3,5-diiodo-4-methylphenyl)acrylate | C15H15I2NO3

2-Ethoxyethyl (2Z)-2-cyano-3-(3,5-diiodo-4-methylphenyl)acrylate

  • Molecular FormulaC15H15I2NO3
  • Average mass511.093 Da
  • Monoisotopic mass510.914124 Da
  • ChemSpider ID102505629

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-2-Cyano-3-(3,5-diiodo-4-méthylphényl)acrylate de 2-éthoxyéthyle [French] [ACD/IUPAC Name]
2-Ethoxyethyl (2Z)-2-cyano-3-(3,5-diiodo-4-methylphenyl)acrylate [ACD/IUPAC Name]
2-Ethoxyethyl-(2Z)-2-cyan-3-(3,5-diiod-4-methylphenyl)acrylat [German] [ACD/IUPAC Name]
2-Propenoic acid, 2-cyano-3-(3,5-diiodo-4-methylphenyl)-, 2-ethoxyethyl ester, (2Z)- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 531.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.7±3.0 kJ/mol
Flash Point: 275.3±30.1 °C
Index of Refraction: 1.637
Molar Refractivity: 99.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.12
ACD/LogD (pH 5.5): 4.49
ACD/BCF (pH 5.5): 1526.81
ACD/KOC (pH 5.5): 6615.33
ACD/LogD (pH 7.4): 4.49
ACD/BCF (pH 7.4): 1526.81
ACD/KOC (pH 7.4): 6615.33
Polar Surface Area: 59 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 53.3±3.0 dyne/cm
Molar Volume: 276.4±3.0 cm3

Click to predict properties on the Chemicalize site


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