ChemSpider 2D Image | N,N-Dimethyl-3-[2-(trifluoromethyl)phenyl]-2-propyn-1-amine | C12H12F3N

N,N-Dimethyl-3-[2-(trifluoromethyl)phenyl]-2-propyn-1-amine

  • Molecular FormulaC12H12F3N
  • Average mass227.226 Da
  • Monoisotopic mass227.092178 Da
  • ChemSpider ID28551709

More details:

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

2-Propyn-1-amine, N,N-dimethyl-3-[2-(trifluoromethyl)phenyl]- [ACD/Index Name]
N,N-Dimethyl-3-[2-(trifluormethyl)phenyl]-2-propin-1-amin [German] [ACD/IUPAC Name]
N,N-Dimethyl-3-[2-(trifluoromethyl)phenyl]-2-propyn-1-amine [ACD/IUPAC Name]
N,N-Diméthyl-3-[2-(trifluorométhyl)phényl]-2-propyn-1-amine [French] [ACD/IUPAC Name]
651729-12-3 [RN]
N,N-Dimethyl-3-[2-(trifluoromethyl)phenyl]prop-2-yn-1-amine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 252.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.0±3.0 kJ/mol
Flash Point: 106.4±27.3 °C
Index of Refraction: 1.497
Molar Refractivity: 56.8±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.68
ACD/LogD (pH 5.5): 1.69
ACD/BCF (pH 5.5): 4.40
ACD/KOC (pH 5.5): 33.04
ACD/LogD (pH 7.4): 3.17
ACD/BCF (pH 7.4): 134.05
ACD/KOC (pH 7.4): 1007.07
Polar Surface Area: 3 Å2
Polarizability: 22.5±0.5 10-24cm3
Surface Tension: 34.3±5.0 dyne/cm
Molar Volume: 194.0±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement