ChemSpider 2D Image | 6-(4-Fluorophenyl)-3-(2-methyl-2-propanyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine | C14H15FN4S

6-(4-Fluorophenyl)-3-(2-methyl-2-propanyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

  • Molecular FormulaC14H15FN4S
  • Average mass290.359 Da
  • Monoisotopic mass290.100159 Da
  • ChemSpider ID21599034

More details:

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

6-(4-Fluorophenyl)-3-(2-methyl-2-propanyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine [ACD/IUPAC Name]
6-(4-Fluorophényl)-3-(2-méthyl-2-propanyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine [French] [ACD/IUPAC Name]
6-(4-Fluorphenyl)-3-(2-methyl-2-propanyl)-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, 3-(1,1-dimethylethyl)-6-(4-fluorophenyl)- [ACD/Index Name]
3-tert-butyl-6-(4-fluorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

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

Density: 1.3±0.1 g/cm3
Boiling Point: 443.4±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.1±3.0 kJ/mol
Flash Point: 221.9±29.3 °C
Index of Refraction: 1.659
Molar Refractivity: 80.2±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.96
ACD/LogD (pH 5.5): 3.17
ACD/BCF (pH 5.5): 151.83
ACD/KOC (pH 5.5): 1267.40
ACD/LogD (pH 7.4): 3.17
ACD/BCF (pH 7.4): 151.95
ACD/KOC (pH 7.4): 1268.46
Polar Surface Area: 68 Å2
Polarizability: 31.8±0.5 10-24cm3
Surface Tension: 45.8±7.0 dyne/cm
Molar Volume: 217.6±7.0 cm3

Click to predict properties on the Chemicalize site


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