ChemSpider 2D Image | (2E)-5-(3-Dioxiranylidene)-2-methyl-4-oxo-2-hexenoyl nitrate | C8H7NO7

(2E)-5-(3-Dioxiranylidene)-2-methyl-4-oxo-2-hexenoyl nitrate

  • Molecular FormulaC8H7NO7
  • Average mass229.144 Da
  • Monoisotopic mass229.022247 Da
  • ChemSpider ID67030541

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-5-(3-Dioxiranyliden)-2-methyl-4-oxo-2-hexenoylnitrat [German] [ACD/IUPAC Name]
(2E)-5-(3-Dioxiranylidene)-2-methyl-4-oxo-2-hexenoyl nitrate [ACD/IUPAC Name]
2-Hexene-1,4-dione, 5-(3-dioxiranylidene)-2-methyl-1-(nitrooxy)-, (2E)- [ACD/Index Name]
Nitrate de (2E)-5-(3-dioxiranylidène)-2-méthyl-4-oxo-2-hexenoyle [French] [ACD/IUPAC Name]
peroxymethacryloyl nitrate

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

Density: 1.5±0.1 g/cm3
Boiling Point: 276.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.5±3.0 kJ/mol
Flash Point: 119.0±32.1 °C
Index of Refraction: 1.547
Molar Refractivity: 47.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.47
ACD/LogD (pH 5.5): 1.87
ACD/BCF (pH 5.5): 15.58
ACD/KOC (pH 5.5): 248.45
ACD/LogD (pH 7.4): 1.87
ACD/BCF (pH 7.4): 15.58
ACD/KOC (pH 7.4): 248.45
Polar Surface Area: 114 Å2
Polarizability: 18.9±0.5 10-24cm3
Surface Tension: 58.6±3.0 dyne/cm
Molar Volume: 150.0±3.0 cm3

Click to predict properties on the Chemicalize site


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