ChemSpider 2D Image | N-{3-[Butyl(ethyl)amino]-1-(3,4-dichlorophenyl)-1H-1,2,4-triazol-5-yl}-2-fluorobenzamide | C21H22Cl2FN5O

N-{3-[Butyl(ethyl)amino]-1-(3,4-dichlorophenyl)-1H-1,2,4-triazol-5-yl}-2-fluorobenzamide

  • Molecular FormulaC21H22Cl2FN5O
  • Average mass450.337 Da
  • Monoisotopic mass449.118530 Da
  • ChemSpider ID123178802

More details:

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

Benzamide, N-[3-(butylethylamino)-1-(3,4-dichlorophenyl)-1H-1,2,4-triazol-5-yl]-2-fluoro- [ACD/Index Name]
N-{3-[Butyl(ethyl)amino]-1-(3,4-dichlorophenyl)-1H-1,2,4-triazol-5-yl}-2-fluorobenzamide [ACD/IUPAC Name]
N-{3-[Butyl(éthyl)amino]-1-(3,4-dichlorophényl)-1H-1,2,4-triazol-5-yl}-2-fluorobenzamide [French] [ACD/IUPAC Name]
N-{3-[Butyl(ethyl)amino]-1-(3,4-dichlorphenyl)-1H-1,2,4-triazol-5-yl}-2-fluorbenzamid [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.618
Molar Refractivity: 118.3±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.63
ACD/LogD (pH 5.5): 5.42
ACD/BCF (pH 5.5): 7692.45
ACD/KOC (pH 5.5): 21047.19
ACD/LogD (pH 7.4): 5.42
ACD/BCF (pH 7.4): 7690.35
ACD/KOC (pH 7.4): 21041.43
Polar Surface Area: 63 Å2
Polarizability: 46.9±0.5 10-24cm3
Surface Tension: 45.5±7.0 dyne/cm
Molar Volume: 337.7±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement