ChemSpider 2D Image | N,N'-Bis[2-nitro-4-(trifluoromethyl)phenyl]-1,2-ethanediamine | C16H12F6N4O4

N,N'-Bis[2-nitro-4-(trifluoromethyl)phenyl]-1,2-ethanediamine

  • Molecular FormulaC16H12F6N4O4
  • Average mass438.281 Da
  • Monoisotopic mass438.076263 Da
  • ChemSpider ID28330264

More details:

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

1,2-Ethanediamine, N1,N2-bis[2-nitro-4-(trifluoromethyl)phenyl]- [ACD/Index Name]
N,N'-Bis[2-nitro-4-(trifluormethyl)phenyl]-1,2-ethandiamin [German] [ACD/IUPAC Name]
N,N'-Bis[2-nitro-4-(trifluoromethyl)phenyl]-1,2-ethanediamine [ACD/IUPAC Name]
N,N'-Bis[2-nitro-4-(trifluorométhyl)phényl]-1,2-éthanediamine [French] [ACD/IUPAC Name]
1256749-87-7 [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: 513.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.4±3.0 kJ/mol
Flash Point: 264.1±30.1 °C
Index of Refraction: 1.577
Molar Refractivity: 92.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 6.17
ACD/LogD (pH 5.5): 5.58
ACD/BCF (pH 5.5): 10302.73
ACD/KOC (pH 5.5): 25945.41
ACD/LogD (pH 7.4): 5.58
ACD/BCF (pH 7.4): 10302.73
ACD/KOC (pH 7.4): 25945.41
Polar Surface Area: 116 Å2
Polarizability: 36.8±0.5 10-24cm3
Surface Tension: 45.1±3.0 dyne/cm
Molar Volume: 279.9±3.0 cm3

Click to predict properties on the Chemicalize site


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