ChemSpider 2D Image | 3-Cyclopropyl-6-[4-(1H-1,2,4-triazol-3-yl)phenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole | C14H11N7S

3-Cyclopropyl-6-[4-(1H-1,2,4-triazol-3-yl)phenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

  • Molecular FormulaC14H11N7S
  • Average mass309.349 Da
  • Monoisotopic mass309.079651 Da
  • ChemSpider ID29567433

More details:

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

1,2,4-Triazolo[3,4-b][1,3,4]thiadiazole, 3-cyclopropyl-6-[4-(1H-1,2,4-triazol-3-yl)phenyl]- [ACD/Index Name]
3-Cyclopropyl-6-[4-(1H-1,2,4-triazol-3-yl)phenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol [German] [ACD/IUPAC Name]
3-Cyclopropyl-6-[4-(1H-1,2,4-triazol-3-yl)phenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole [ACD/IUPAC Name]
3-Cyclopropyl-6-[4-(1H-1,2,4-triazol-3-yl)phényl][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: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.998
Molar Refractivity: 84.4±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.61
ACD/LogD (pH 5.5): 1.94
ACD/BCF (pH 5.5): 17.65
ACD/KOC (pH 5.5): 271.63
ACD/LogD (pH 7.4): 1.94
ACD/BCF (pH 7.4): 17.54
ACD/KOC (pH 7.4): 269.95
Polar Surface Area: 113 Å2
Polarizability: 33.5±0.5 10-24cm3
Surface Tension: 91.8±7.0 dyne/cm
Molar Volume: 169.0±7.0 cm3

Click to predict properties on the Chemicalize site


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