ChemSpider 2D Image | 6-(2,4-Difluorophenyl)-3-(3-methylphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine | C17H12F2N4S

6-(2,4-Difluorophenyl)-3-(3-methylphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

  • Molecular FormulaC17H12F2N4S
  • Average mass342.366 Da
  • Monoisotopic mass342.075073 Da
  • ChemSpider ID21130194

More details:

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

6-(2,4-Difluorophenyl)-3-(3-methylphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine [ACD/IUPAC Name]
6-(2,4-Difluorophényl)-3-(3-méthylphényl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine [French] [ACD/IUPAC Name]
6-(2,4-Difluorphenyl)-3-(3-methylphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin [German] [ACD/IUPAC Name]
7H-1,2,4-Triazolo[3,4-b][1,3,4]thiadiazine, 6-(2,4-difluorophenyl)-3-(3-methylphenyl)- [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: 520.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.3±3.0 kJ/mol
Flash Point: 268.4±32.9 °C
Index of Refraction: 1.698
Molar Refractivity: 91.2±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.47
ACD/LogD (pH 5.5): 3.44
ACD/BCF (pH 5.5): 240.85
ACD/KOC (pH 5.5): 1763.81
ACD/LogD (pH 7.4): 3.44
ACD/BCF (pH 7.4): 240.87
ACD/KOC (pH 7.4): 1763.95
Polar Surface Area: 68 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 49.4±7.0 dyne/cm
Molar Volume: 236.6±7.0 cm3

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