ChemSpider 2D Image | N-{2,4-Dichloro-3-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]phenyl}methanesulfonamide | C11H10Cl2F2N4O3S

N-{2,4-Dichloro-3-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]phenyl}methanesulfonamide

  • Molecular FormulaC11H10Cl2F2N4O3S
  • Average mass387.190 Da
  • Monoisotopic mass385.981873 Da
  • ChemSpider ID110060891

More details:

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

Methanesulfonamide, N-[2,4-dichloro-3-[4-(difluoromethyl)-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl]phenyl]- [ACD/Index Name]
N-{2,4-Dichlor-3-[4-(difluormethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]phenyl}methansulfonamid [German] [ACD/IUPAC Name]
N-{2,4-Dichloro-3-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]phenyl}methanesulfonamide [ACD/IUPAC Name]
N-{2,4-Dichloro-3-[4-(difluorométhyl)-3-méthyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]phényl}méthanesulfonamide [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 452.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.2±3.0 kJ/mol
Flash Point: 227.7±31.5 °C
Index of Refraction: 1.646
Molar Refractivity: 81.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.21
ACD/LogD (pH 5.5): 2.30
ACD/BCF (pH 5.5): 32.60
ACD/KOC (pH 5.5): 414.05
ACD/LogD (pH 7.4): 1.56
ACD/BCF (pH 7.4): 5.89
ACD/KOC (pH 7.4): 74.83
Polar Surface Area: 90 Å2
Polarizability: 32.2±0.5 10-24cm3
Surface Tension: 54.0±7.0 dyne/cm
Molar Volume: 224.0±7.0 cm3

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