ChemSpider 2D Image | N-Benzyl-N-(3-methylbutyl)-3-(trifluoromethyl)aniline | C19H22F3N

N-Benzyl-N-(3-methylbutyl)-3-(trifluoromethyl)aniline

  • Molecular FormulaC19H22F3N
  • Average mass321.380 Da
  • Monoisotopic mass321.170441 Da
  • ChemSpider ID102758283

More details:

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

Benzenemethanamine, N-(3-methylbutyl)-N-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
N-Benzyl-N-(3-methylbutyl)-3-(trifluormethyl)anilin [German] [ACD/IUPAC Name]
N-Benzyl-N-(3-methylbutyl)-3-(trifluoromethyl)aniline [ACD/IUPAC Name]
N-Benzyl-N-(3-méthylbutyl)-3-(trifluorométhyl)aniline [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 389.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.9±3.0 kJ/mol
Flash Point: 189.4±27.9 °C
Index of Refraction: 1.527
Molar Refractivity: 88.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 7.48
ACD/LogD (pH 5.5): 6.12
ACD/BCF (pH 5.5): 26038.05
ACD/KOC (pH 5.5): 49740.17
ACD/LogD (pH 7.4): 6.14
ACD/BCF (pH 7.4): 27224.23
ACD/KOC (pH 7.4): 52006.12
Polar Surface Area: 3 Å2
Polarizability: 35.1±0.5 10-24cm3
Surface Tension: 33.9±3.0 dyne/cm
Molar Volume: 288.0±3.0 cm3

Click to predict properties on the Chemicalize site


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