ChemSpider 2D Image | 2-(4-Fluorophenyl)-N-methyl-1-(4H-1,2,4-triazol-3-yl)ethanamine | C11H13FN4

2-(4-Fluorophenyl)-N-methyl-1-(4H-1,2,4-triazol-3-yl)ethanamine

  • Molecular FormulaC11H13FN4
  • Average mass220.246 Da
  • Monoisotopic mass220.112427 Da
  • ChemSpider ID48714728

More details:

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

2-(4-Fluorophenyl)-N-methyl-1-(4H-1,2,4-triazol-3-yl)ethanamine [ACD/IUPAC Name]
2-(4-Fluorophényl)-N-méthyl-1-(4H-1,2,4-triazol-3-yl)éthanamine [French] [ACD/IUPAC Name]
2-(4-Fluorphenyl)-N-methyl-1-(4H-1,2,4-triazol-3-yl)ethanamin [German] [ACD/IUPAC Name]
4H-1,2,4-Triazole-3-methanamine, α-[(4-fluorophenyl)methyl]-N-methyl- [ACD/Index Name]
[2-(4-fluorophenyl)-1-(4H-1,2,4-triazol-3-yl)ethyl](methyl)amine
1467422-22-5 [RN]
MFCD21222231

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

Density: 1.2±0.1 g/cm3
Boiling Point: 404.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.6±3.0 kJ/mol
Flash Point: 198.4±31.5 °C
Index of Refraction: 1.579
Molar Refractivity: 59.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.93
ACD/LogD (pH 5.5): -0.66
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.79
ACD/LogD (pH 7.4): 0.77
ACD/BCF (pH 7.4): 1.98
ACD/KOC (pH 7.4): 48.25
Polar Surface Area: 54 Å2
Polarizability: 23.4±0.5 10-24cm3
Surface Tension: 51.8±3.0 dyne/cm
Molar Volume: 178.0±3.0 cm3

Click to predict properties on the Chemicalize site


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