ChemSpider 2D Image | 2-Methoxy-1,3,4-trinitrobenzene | C7H5N3O7

2-Methoxy-1,3,4-trinitrobenzene

  • Molecular FormulaC7H5N3O7
  • Average mass243.130 Da
  • Monoisotopic mass243.012756 Da
  • ChemSpider ID35792270

More details:

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

2-Methoxy-1,3,4-trinitrobenzene [ACD/IUPAC Name]
2-Méthoxy-1,3,4-trinitrobenzène [French] [ACD/IUPAC Name]
2-Methoxy-1,3,4-trinitrobenzol [German] [ACD/IUPAC Name]
Benzene, 2-methoxy-1,3,4-trinitro- [ACD/Index Name]
88106-08-5 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 457.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.0±3.0 kJ/mol
Flash Point: 236.6±29.3 °C
Index of Refraction: 1.624
Molar Refractivity: 52.6±0.3 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 1.14
ACD/LogD (pH 5.5): 1.68
ACD/BCF (pH 5.5): 11.10
ACD/KOC (pH 5.5): 194.88
ACD/LogD (pH 7.4): 1.68
ACD/BCF (pH 7.4): 11.10
ACD/KOC (pH 7.4): 194.88
Polar Surface Area: 147 Å2
Polarizability: 20.8±0.5 10-24cm3
Surface Tension: 69.7±3.0 dyne/cm
Molar Volume: 149.0±3.0 cm3

Click to predict properties on the Chemicalize site


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