ChemSpider 2D Image | 2,3-Dimethoxy-5-(~2~H_3_)methyl-1,4-benzoquinone | C9H7D3O4

2,3-Dimethoxy-5-(2H3)methyl-1,4-benzoquinone

  • Molecular FormulaC9H7D3O4
  • Average mass185.192 Da
  • Monoisotopic mass185.076736 Da
  • ChemSpider ID8734812

  • Non-standard isotope - Non-standard isotope

More details:

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

2,3-Dimethoxy-5-(2H3)methyl-1,4-benzochinon [German] [ACD/IUPAC Name]
2,3-Dimethoxy-5-(2H3)methyl-1,4-benzoquinone [ACD/IUPAC Name]
2,3-Diméthoxy-5-(2H3)méthyl-1,4-benzoquinone [French] [ACD/IUPAC Name]
2,5-Cyclohexadiene-1,4-dione, 2,3-dimethoxy-5-(methyl-d3)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 331.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.4±3.0 kJ/mol
Flash Point: 148.6±27.9 °C
Index of Refraction: 1.498
Molar Refractivity: 44.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.12
ACD/LogD (pH 5.5): 0.57
ACD/BCF (pH 5.5): 1.61
ACD/KOC (pH 5.5): 48.92
ACD/LogD (pH 7.4): 0.57
ACD/BCF (pH 7.4): 1.61
ACD/KOC (pH 7.4): 48.92
Polar Surface Area: 53 Å2
Polarizability: 17.6±0.5 10-24cm3
Surface Tension: 37.5±5.0 dyne/cm
Molar Volume: 151.9±5.0 cm3

Click to predict properties on the Chemicalize site


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