ChemSpider 2D Image | Ethyl (2Z)-2-cyano-3-(6-nitro-1,3-benzodioxol-5-yl)acrylate | C13H10N2O6

Ethyl (2Z)-2-cyano-3-(6-nitro-1,3-benzodioxol-5-yl)acrylate

  • Molecular FormulaC13H10N2O6
  • Average mass290.228 Da
  • Monoisotopic mass290.053894 Da
  • ChemSpider ID20060021

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-2-Cyano-3-(6-nitro-1,3-benzodioxol-5-yl)acrylate d'éthyle [French] [ACD/IUPAC Name]
2-Cyano-3-(6-nitro-benzo[1,3]dioxol-5-yl)-acrylic acid ethyl ester
2-Propenoic acid, 2-cyano-3-(6-nitro-1,3-benzodioxol-5-yl)-, ethyl ester, (2Z)- [ACD/Index Name]
Ethyl (2Z)-2-cyano-3-(6-nitro-1,3-benzodioxol-5-yl)acrylate [ACD/IUPAC Name]
Ethyl-(2Z)-2-cyan-3-(6-nitro-1,3-benzodioxol-5-yl)acrylat [German] [ACD/IUPAC Name]
ethyl (2Z)-2-cyano-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enoate

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

Density: 1.5±0.1 g/cm3
Boiling Point: 474.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.8±3.0 kJ/mol
Flash Point: 240.6±28.7 °C
Index of Refraction: 1.622
Molar Refractivity: 70.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.44
ACD/LogD (pH 5.5): 2.46
ACD/BCF (pH 5.5): 43.45
ACD/KOC (pH 5.5): 517.73
ACD/LogD (pH 7.4): 2.46
ACD/BCF (pH 7.4): 43.45
ACD/KOC (pH 7.4): 517.73
Polar Surface Area: 114 Å2
Polarizability: 27.9±0.5 10-24cm3
Surface Tension: 66.3±3.0 dyne/cm
Molar Volume: 199.6±3.0 cm3

Click to predict properties on the Chemicalize site


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