ChemSpider 2D Image | N-{2-[(2-Chloro-4-fluorobenzyl)oxy]-3-methoxybenzyl}cyclohexanamine | C21H25ClFNO2

N-{2-[(2-Chloro-4-fluorobenzyl)oxy]-3-methoxybenzyl}cyclohexanamine

  • Molecular FormulaC21H25ClFNO2
  • Average mass377.880 Da
  • Monoisotopic mass377.155792 Da
  • ChemSpider ID21536431

More details:

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

Benzenemethanamine, 2-[(2-chloro-4-fluorophenyl)methoxy]-N-cyclohexyl-3-methoxy- [ACD/Index Name]
N-{2-[(2-Chlor-4-fluorbenzyl)oxy]-3-methoxybenzyl}cyclohexanamin [German] [ACD/IUPAC Name]
N-{2-[(2-Chloro-4-fluorobenzyl)oxy]-3-methoxybenzyl}cyclohexanamine [ACD/IUPAC Name]
N-{2-[(2-Chloro-4-fluorobenzyl)oxy]-3-méthoxybenzyl}cyclohexanamine [French] [ACD/IUPAC Name]
N-({2-[(2-CHLORO-4-FLUOROPHENYL)METHOXY]-3-METHOXYPHENYL}METHYL)CYCLOHEXANAMINE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 475.3±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.9±3.0 kJ/mol
Flash Point: 241.2±27.3 °C
Index of Refraction: 1.572
Molar Refractivity: 103.1±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.18
ACD/LogD (pH 5.5): 1.81
ACD/BCF (pH 5.5): 2.57
ACD/KOC (pH 5.5): 9.30
ACD/LogD (pH 7.4): 2.78
ACD/BCF (pH 7.4): 24.01
ACD/KOC (pH 7.4): 86.75
Polar Surface Area: 30 Å2
Polarizability: 40.9±0.5 10-24cm3
Surface Tension: 46.0±5.0 dyne/cm
Molar Volume: 313.5±5.0 cm3

Click to predict properties on the Chemicalize site


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