ChemSpider 2D Image | 2-(Trifluoromethyl)(4,5-~2~H_2_)aniline | C7H4D2F3N

2-(Trifluoromethyl)(4,5-2H2)aniline

  • Molecular FormulaC7H4D2F3N
  • Average mass163.137 Da
  • Monoisotopic mass163.057785 Da
  • ChemSpider ID58794170

  • Non-standard isotope - Non-standard isotope

More details:

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

2-(Trifluormethyl)(4,5-2H2)anilin [German] [ACD/IUPAC Name]
2-(Trifluoromethyl)(4,5-2H2)aniline [ACD/IUPAC Name]
2-(Trifluorométhyl)(4,5-2H2)aniline [French] [ACD/IUPAC Name]
Benzen-3,4-d2-amine, 6-(trifluoromethyl)- [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: 174.8±0.0 °C at 760 mmHg
Vapour Pressure: 1.2±0.3 mmHg at 25°C
Enthalpy of Vaporization: 41.1±3.0 kJ/mol
Flash Point: 55.0±0.0 °C
Index of Refraction: 1.478
Molar Refractivity: 35.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.41
ACD/LogD (pH 5.5): 2.13
ACD/BCF (pH 5.5): 24.57
ACD/KOC (pH 5.5): 344.28
ACD/LogD (pH 7.4): 2.13
ACD/BCF (pH 7.4): 24.58
ACD/KOC (pH 7.4): 344.29
Polar Surface Area: 26 Å2
Polarizability: 14.1±0.5 10-24cm3
Surface Tension: 28.9±3.0 dyne/cm
Molar Volume: 125.2±3.0 cm3

Click to predict properties on the Chemicalize site


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