ChemSpider 2D Image | N-{[1-(3-Chloro-4-fluorophenyl)-1H-1,2,3-triazol-4-yl]methyl}methionine | C14H16ClFN4O2S

N-{[1-(3-Chloro-4-fluorophenyl)-1H-1,2,3-triazol-4-yl]methyl}methionine

  • Molecular FormulaC14H16ClFN4O2S
  • Average mass358.819 Da
  • Monoisotopic mass358.066650 Da
  • ChemSpider ID64092189

More details:

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

Methionine, N-[[1-(3-chloro-4-fluorophenyl)-1H-1,2,3-triazol-4-yl]methyl]- [ACD/Index Name]
N-{[1-(3-Chlor-4-fluorphenyl)-1H-1,2,3-triazol-4-yl]methyl}methionin [German] [ACD/IUPAC Name]
N-{[1-(3-Chloro-4-fluorophenyl)-1H-1,2,3-triazol-4-yl]methyl}methionine [ACD/IUPAC Name]
N-{[1-(3-Chloro-4-fluorophényl)-1H-1,2,3-triazol-4-yl]méthyl}méthionine [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 571.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.1±3.0 kJ/mol
Flash Point: 299.3±32.9 °C
Index of Refraction: 1.641
Molar Refractivity: 88.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.15
ACD/LogD (pH 5.5): 0.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.37
ACD/LogD (pH 7.4): -0.66
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 105 Å2
Polarizability: 35.2±0.5 10-24cm3
Surface Tension: 51.9±7.0 dyne/cm
Molar Volume: 246.3±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement