ChemSpider 2D Image | 3-(2-ethoxyphenyl)-6-(phenoxymethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole | C18H16N4O2S

3-(2-ethoxyphenyl)-6-(phenoxymethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

  • Molecular FormulaC18H16N4O2S
  • Average mass352.410 Da
  • Monoisotopic mass352.099396 Da
  • ChemSpider ID21127108

More details:

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

3-(2-Ethoxyphenyl)-6-(phenoxymethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol [German] [ACD/IUPAC Name]
3-(2-Éthoxyphényl)-6-(phénoxyméthyl)[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: 1.686
Molar Refractivity: 98.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.59
ACD/LogD (pH 5.5): 3.32
ACD/BCF (pH 5.5): 196.03
ACD/KOC (pH 5.5): 1522.11
ACD/LogD (pH 7.4): 3.32
ACD/BCF (pH 7.4): 196.03
ACD/KOC (pH 7.4): 1522.11
Polar Surface Area: 90 Å2
Polarizability: 39.2±0.5 10-24cm3
Surface Tension: 53.9±7.0 dyne/cm
Molar Volume: 259.8±7.0 cm3

Click to predict properties on the Chemicalize site


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