ChemSpider 2D Image | 1-(4-Bromophenyl)-1-fluoro-2-propanamine | C9H11BrFN

1-(4-Bromophenyl)-1-fluoro-2-propanamine

  • Molecular FormulaC9H11BrFN
  • Average mass232.093 Da
  • Monoisotopic mass231.005890 Da
  • ChemSpider ID49615799

More details:

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

1-(4-Bromophenyl)-1-fluoro-2-propanamine [ACD/IUPAC Name]
1-(4-Bromophényl)-1-fluoro-2-propanamine [French] [ACD/IUPAC Name]
1-(4-Bromphenyl)-1-fluor-2-propanamin [German] [ACD/IUPAC Name]
Benzeneethanamine, 4-bromo-β-fluoro-α-methyl- [ACD/Index Name]
1780470-64-5 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 297.8±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.8±3.0 kJ/mol
Flash Point: 133.9±23.2 °C
Index of Refraction: 1.539
Molar Refractivity: 51.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.61
ACD/LogD (pH 5.5): -0.71
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.87
ACD/BCF (pH 7.4): 1.36
ACD/KOC (pH 7.4): 19.36
Polar Surface Area: 26 Å2
Polarizability: 20.5±0.5 10-24cm3
Surface Tension: 37.5±3.0 dyne/cm
Molar Volume: 165.2±3.0 cm3

Click to predict properties on the Chemicalize site


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