ChemSpider 2D Image | 6-(5-Fluoro-2-methylbenzyl)-3-isopropyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole | C14H15FN4S

6-(5-Fluoro-2-methylbenzyl)-3-isopropyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

  • Molecular FormulaC14H15FN4S
  • Average mass290.359 Da
  • Monoisotopic mass290.100159 Da
  • ChemSpider ID29576768

More details:

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

1,2,4-Triazolo[3,4-b][1,3,4]thiadiazole, 6-[(5-fluoro-2-methylphenyl)methyl]-3-(1-methylethyl)- [ACD/Index Name]
6-(5-Fluor-2-methylbenzyl)-3-isopropyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol [German] [ACD/IUPAC Name]
6-(5-Fluoro-2-methylbenzyl)-3-isopropyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole [ACD/IUPAC Name]
6-(5-Fluoro-2-méthylbenzyl)-3-isopropyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole [French] [ACD/IUPAC 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.674
Molar Refractivity: 79.7±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.69
ACD/LogD (pH 5.5): 3.15
ACD/BCF (pH 5.5): 145.29
ACD/KOC (pH 5.5): 1228.37
ACD/LogD (pH 7.4): 3.15
ACD/BCF (pH 7.4): 145.29
ACD/KOC (pH 7.4): 1228.38
Polar Surface Area: 71 Å2
Polarizability: 31.6±0.5 10-24cm3
Surface Tension: 45.5±7.0 dyne/cm
Molar Volume: 212.2±7.0 cm3

Click to predict properties on the Chemicalize site


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