ChemSpider 2D Image | 4-[(1E)-3,3,3-Trifluoro-1-propen-1-yl]aniline | C9H8F3N

4-[(1E)-3,3,3-Trifluoro-1-propen-1-yl]aniline

  • Molecular FormulaC9H8F3N
  • Average mass187.162 Da
  • Monoisotopic mass187.060883 Da
  • ChemSpider ID35763040

  • Double-bond stereo - Double-bond stereo

More details:

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

4-[(1E)-3,3,3-Trifluor-1-propen-1-yl]anilin [German] [ACD/IUPAC Name]
4-[(1E)-3,3,3-Trifluoro-1-propen-1-yl]aniline [ACD/IUPAC Name]
4-[(1E)-3,3,3-Trifluoro-1-propén-1-yl]aniline [French] [ACD/IUPAC Name]
Benzenamine, 4-[(1E)-3,3,3-trifluoro-1-propen-1-yl]- [ACD/Index Name]
1089296-90-1 [RN]
1983-15-9 [RN]
4-(3,3,3-Trifluoroprop-1-en-1-yl)aniline
4-[(1E)-3,3,3-trifluoroprop-1-en-1-yl]aniline
BENZENAMINE, 4-(3,3,3-TRIFLUORO-1-PROPENYL)-
MFCD20692504

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

Density: 1.3±0.1 g/cm3
Boiling Point: 282.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.1±3.0 kJ/mol
Flash Point: 124.5±20.1 °C
Index of Refraction: 1.541
Molar Refractivity: 46.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.99
ACD/LogD (pH 5.5): 2.36
ACD/BCF (pH 5.5): 36.51
ACD/KOC (pH 5.5): 453.83
ACD/LogD (pH 7.4): 2.37
ACD/BCF (pH 7.4): 37.43
ACD/KOC (pH 7.4): 465.25
Polar Surface Area: 26 Å2
Polarizability: 18.6±0.5 10-24cm3
Surface Tension: 33.9±3.0 dyne/cm
Molar Volume: 149.1±3.0 cm3

Click to predict properties on the Chemicalize site


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