ChemSpider 2D Image | N,2,4-Trinitroaniline | C6H4N4O6

N,2,4-Trinitroaniline

  • Molecular FormulaC6H4N4O6
  • Average mass228.119 Da
  • Monoisotopic mass228.013077 Da
  • ChemSpider ID35763079

More details:

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

Benzenamine, N,2,4-trinitro- [ACD/Index Name]
N,2,4-Trinitroanilin [German] [ACD/IUPAC Name]
N,2,4-Trinitroaniline [ACD/IUPAC Name]
N,2,4-Trinitroaniline [French] [ACD/IUPAC Name]
20020-15-9 [RN]
N-(2,4-Dinitrophenyl)nitramide
N-nitro-2,4-dinitroaniline

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

Density: 1.8±0.1 g/cm3
Boiling Point: 413.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.6±3.0 kJ/mol
Flash Point: 203.9±31.5 °C
Index of Refraction: 1.710
Molar Refractivity: 50.3±0.3 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 2.22
ACD/LogD (pH 5.5): -0.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.21
ACD/LogD (pH 7.4): -0.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.78
Polar Surface Area: 149 Å2
Polarizability: 20.0±0.5 10-24cm3
Surface Tension: 89.1±3.0 dyne/cm
Molar Volume: 128.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement