ChemSpider 2D Image | N-[2-(4-Bromo-2-fluorophenoxy)ethyl]cyclopentanamine | C13H17BrFNO

N-[2-(4-Bromo-2-fluorophenoxy)ethyl]cyclopentanamine

  • Molecular FormulaC13H17BrFNO
  • Average mass302.183 Da
  • Monoisotopic mass301.047760 Da
  • ChemSpider ID34026781

More details:

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

Cyclopentanamine, N-[2-(4-bromo-2-fluorophenoxy)ethyl]- [ACD/Index Name]
N-[2-(4-Brom-2-fluorphenoxy)ethyl]cyclopentanamin [German] [ACD/IUPAC Name]
N-[2-(4-Bromo-2-fluorophenoxy)ethyl]cyclopentanamine [ACD/IUPAC Name]
N-[2-(4-Bromo-2-fluorophénoxy)éthyl]cyclopentanamine [French] [ACD/IUPAC Name]
1271107-45-9 [RN]
MFCD17361416
N-(2-(4-bromo-2-fluorophenoxy)ethyl)cyclopentanamine

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

Density: 1.4±0.1 g/cm3
Boiling Point: 381.4±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.0±3.0 kJ/mol
Flash Point: 184.5±25.1 °C
Index of Refraction: 1.557
Molar Refractivity: 70.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.01
ACD/LogD (pH 5.5): 0.87
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.17
ACD/LogD (pH 7.4): 2.21
ACD/BCF (pH 7.4): 11.51
ACD/KOC (pH 7.4): 69.10
Polar Surface Area: 21 Å2
Polarizability: 27.9±0.5 10-24cm3
Surface Tension: 43.0±5.0 dyne/cm
Molar Volume: 218.5±5.0 cm3

Click to predict properties on the Chemicalize site


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