ChemSpider 2D Image | 2-sec-Butyl-4,6-dinitro(O-~2~H)phenol | C10H11DN2O5

2-sec-Butyl-4,6-dinitro(O-2H)phenol

  • Molecular FormulaC10H11DN2O5
  • Average mass241.219 Da
  • Monoisotopic mass241.080902 Da
  • ChemSpider ID95732575

  • Non-standard isotope - Non-standard isotope

More details:

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

2-sec-Butyl-4,6-dinitro(O-2H)phenol [German] [ACD/IUPAC Name]
2-sec-Butyl-4,6-dinitro(O-2H)phenol [ACD/IUPAC Name]
2-sec-Butyl-4,6-dinitro(O-2H)phénol [French] [ACD/IUPAC Name]
Phenol-d, 2-(1-methylpropyl)-4,6-dinitro- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 318.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.2±3.0 kJ/mol
Flash Point: 132.0±16.3 °C
Index of Refraction: 1.589
Molar Refractivity: 60.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.61
ACD/LogD (pH 5.5): 1.89
ACD/BCF (pH 5.5): 7.34
ACD/KOC (pH 5.5): 57.06
ACD/LogD (pH 7.4): 0.39
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.80
Polar Surface Area: 112 Å2
Polarizability: 23.8±0.5 10-24cm3
Surface Tension: 56.4±3.0 dyne/cm
Molar Volume: 178.1±3.0 cm3

Click to predict properties on the Chemicalize site


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