ChemSpider 2D Image | 3-Chloro-4-(2,3-difluorophenyl)-5-methyl-4H-1,2,4-triazole | C9H6ClF2N3

3-Chloro-4-(2,3-difluorophenyl)-5-methyl-4H-1,2,4-triazole

  • Molecular FormulaC9H6ClF2N3
  • Average mass229.614 Da
  • Monoisotopic mass229.021835 Da
  • ChemSpider ID43373045

More details:

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

3-Chlor-4-(2,3-difluorphenyl)-5-methyl-4H-1,2,4-triazol [German] [ACD/IUPAC Name]
3-Chloro-4-(2,3-difluorophenyl)-5-methyl-4H-1,2,4-triazole [ACD/IUPAC Name]
3-Chloro-4-(2,3-difluorophényl)-5-méthyl-4H-1,2,4-triazole [French] [ACD/IUPAC Name]
4H-1,2,4-Triazole, 3-chloro-4-(2,3-difluorophenyl)-5-methyl- [ACD/Index Name]
1344295-26-6 [RN]
MFCD18346240

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

Density: 1.5±0.1 g/cm3
Boiling Point: 368.4±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.5±3.0 kJ/mol
Flash Point: 176.6±30.7 °C
Index of Refraction: 1.602
Molar Refractivity: 53.1±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.85
ACD/LogD (pH 5.5): 2.64
ACD/BCF (pH 5.5): 59.67
ACD/KOC (pH 5.5): 649.67
ACD/LogD (pH 7.4): 2.64
ACD/BCF (pH 7.4): 59.67
ACD/KOC (pH 7.4): 649.67
Polar Surface Area: 31 Å2
Polarizability: 21.1±0.5 10-24cm3
Surface Tension: 39.2±7.0 dyne/cm
Molar Volume: 154.9±7.0 cm3

Click to predict properties on the Chemicalize site


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