ChemSpider 2D Image | 1-[3-(Trifluoromethyl)phenyl]-1-butanamine | C11H14F3N

1-[3-(Trifluoromethyl)phenyl]-1-butanamine

  • Molecular FormulaC11H14F3N
  • Average mass217.231 Da
  • Monoisotopic mass217.107834 Da
  • ChemSpider ID24050442

More details:






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

1-[3-(Trifluormethyl)phenyl]-1-butanamin [German] [ACD/IUPAC Name]
1-[3-(Trifluoromethyl)phenyl]-1-butanamine [ACD/IUPAC Name]
1-[3-(Trifluorométhyl)phényl]-1-butanamine [French] [ACD/IUPAC Name]
Benzenemethanamine, α-propyl-3-(trifluoromethyl)- [ACD/Index Name]
1-[3-(trifluoromethyl)phenyl]butan-1-amine
708253-40-1 [RN]
MFCD11148427 [MDL number]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 226.0±35.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 46.2±3.0 kJ/mol
Flash Point: 94.6±10.6 °C
Index of Refraction: 1.467
Molar Refractivity: 53.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.07
ACD/LogD (pH 5.5): 0.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.16
ACD/LogD (pH 7.4): 1.43
ACD/BCF (pH 7.4): 2.99
ACD/KOC (pH 7.4): 27.09
Polar Surface Area: 26 Å2
Polarizability: 21.2±0.5 10-24cm3
Surface Tension: 29.0±3.0 dyne/cm
Molar Volume: 193.2±3.0 cm3

Click to predict properties on the Chemicalize site






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