ChemSpider 2D Image | 2-(~2~H_3_)Methyl-4,6-dinitrophenol | C7H3D3N2O5

2-(2H3)Methyl-4,6-dinitrophenol

  • Molecular FormulaC7H3D3N2O5
  • Average mass201.151 Da
  • Monoisotopic mass201.046509 Da
  • ChemSpider ID24533616

  • Non-standard isotope - Non-standard isotope

More details:

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

1219804-69-9 [RN]
2-(2H3)Methyl-4,6-dinitrophenol [ACD/IUPAC Name]
2-(2H3)Methyl-4,6-dinitrophenol [German] [ACD/IUPAC Name]
2-(2H3)Méthyl-4,6-dinitrophénol [French] [ACD/IUPAC Name]
Phenol, 2-(methyl-d3)-4,6-dinitro- [ACD/Index Name]
2-Methyl-4,6-dinitrophenol [ACD/IUPAC Name]
3,5-Dinitro-2-hydroxy-toluene
4,6-Dinitro-2-methyl-d3-phenol
4,6-Dinitro-o-cresol

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

Density: 1.5±0.1 g/cm3
Boiling Point: 332.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.8±3.0 kJ/mol
Flash Point: 149.2±16.3 °C
Index of Refraction: 1.640
Molar Refractivity: 46.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.19
ACD/LogD (pH 5.5): 1.16
ACD/BCF (pH 5.5): 2.41
ACD/KOC (pH 5.5): 31.54
ACD/LogD (pH 7.4): -0.49
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 112 Å2
Polarizability: 18.3±0.5 10-24cm3
Surface Tension: 70.9±3.0 dyne/cm
Molar Volume: 127.8±3.0 cm3

Click to predict properties on the Chemicalize site


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