ChemSpider 2D Image | 3,4-Dichloro-5,6-dioxo-1,3-cyclohexadiene-1,2-dicarbonitrile | C8Cl2N2O2

3,4-Dichloro-5,6-dioxo-1,3-cyclohexadiene-1,2-dicarbonitrile

  • Molecular FormulaC8Cl2N2O2
  • Average mass227.004 Da
  • Monoisotopic mass225.933685 Da
  • ChemSpider ID28714311

More details:

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

1,3-Cyclohexadiene-1,2-dicarbonitrile, 3,4-dichloro-5,6-dioxo- [ACD/Index Name]
3,4-Dichlor-5,6-dioxo-1,3-cyclohexadien-1,2-dicarbonitril [German] [ACD/IUPAC Name]
3,4-Dichloro-5,6-dioxo-1,3-cyclohexadiene-1,2-dicarbonitrile [ACD/IUPAC Name]
3,4-Dichloro-5,6-dioxo-1,3-cyclohexadiène-1,2-dicarbonitrile [French] [ACD/IUPAC Name]
3,4-Dichloro-5,6-dioxocyclohexa-1,3-diene-1,2-dicarbonitrile
98166-92-8 [RN]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 161.8±40.0 °C at 760 mmHg
Vapour Pressure: 2.2±0.3 mmHg at 25°C
Enthalpy of Vaporization: 39.8±3.0 kJ/mol
Flash Point: 51.6±27.3 °C
Index of Refraction: 1.601
Molar Refractivity: 45.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.65
ACD/LogD (pH 5.5): 0.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 31.76
ACD/LogD (pH 7.4): 0.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 31.76
Polar Surface Area: 82 Å2
Polarizability: 18.1±0.5 10-24cm3
Surface Tension: 71.4±5.0 dyne/cm
Molar Volume: 133.5±5.0 cm3

Click to predict properties on the Chemicalize site


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