Found 23 results

Search term: MF = 'C_{18}H_{17}ClF_{2}N_{4}O_{2}S'
ChemSpider 2D Image | 1-{5-[(4-Chloro-3-methylphenoxy)methyl]-2-furyl}-N-[3-(difluoromethyl)-5-(ethylsulfanyl)-4H-1,2,4-triazol-4-yl]methanimine | C18H17ClF2N4O2S

1-{5-[(4-Chloro-3-methylphenoxy)methyl]-2-furyl}-N-[3-(difluoromethyl)-5-(ethylsulfanyl)-4H-1,2,4-triazol-4-yl]methanimine

  • Molecular FormulaC18H17ClF2N4O2S
  • Average mass426.868 Da
  • Monoisotopic mass426.072876 Da
  • ChemSpider ID35352802

More details:

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

1-{5-[(4-Chlor-3-methylphenoxy)methyl]-2-furyl}-N-[3-(difluormethyl)-5-(ethylsulfanyl)-4H-1,2,4-triazol-4-yl]methanimin [German] [ACD/IUPAC Name]
1-{5-[(4-Chloro-3-methylphenoxy)methyl]-2-furyl}-N-[3-(difluoromethyl)-5-(ethylsulfanyl)-4H-1,2,4-triazol-4-yl]methanimine [ACD/IUPAC Name]
1-{5-[(4-Chloro-3-méthylphénoxy)méthyl]-2-furyl}-N-[3-(difluorométhyl)-5-(éthylsulfanyl)-4H-1,2,4-triazol-4-yl]méthanimine [French] [ACD/IUPAC Name]
4H-1,2,4-Triazol-4-amine, N-[[5-[(4-chloro-3-methylphenoxy)methyl]-2-furanyl]methylene]-3-(difluoromethyl)-5-(ethylthio)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 578.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.6±3.0 kJ/mol
Flash Point: 303.7±32.9 °C
Index of Refraction: 1.615
Molar Refractivity: 105.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.31
ACD/LogD (pH 5.5): 4.86
ACD/BCF (pH 5.5): 2910.83
ACD/KOC (pH 5.5): 10498.75
ACD/LogD (pH 7.4): 4.86
ACD/BCF (pH 7.4): 2910.84
ACD/KOC (pH 7.4): 10498.80
Polar Surface Area: 91 Å2
Polarizability: 41.8±0.5 10-24cm3
Surface Tension: 44.3±7.0 dyne/cm
Molar Volume: 302.5±7.0 cm3

Click to predict properties on the Chemicalize site


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