ChemSpider 2D Image | 4-{[6-(Trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]sulfanyl}-2H-chromen-2-one | C16H8F3N3O2S

4-{[6-(Trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]sulfanyl}-2H-chromen-2-one

  • Molecular FormulaC16H8F3N3O2S
  • Average mass363.314 Da
  • Monoisotopic mass363.028931 Da
  • ChemSpider ID128665990

More details:

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

2H-1-Benzopyran-2-one, 4-[[6-(trifluoromethyl)-1,2,4-triazolo[4,3-a]pyridin-3-yl]thio]- [ACD/Index Name]
4-{[6-(Trifluormethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]sulfanyl}-2H-chromen-2-on [German] [ACD/IUPAC Name]
4-{[6-(Trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]sulfanyl}-2H-chromen-2-one [ACD/IUPAC Name]
4-{[6-(Trifluorométhyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]sulfanyl}-2H-chromén-2-one [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.679
Molar Refractivity: 86.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.47
ACD/LogD (pH 5.5): 3.42
ACD/BCF (pH 5.5): 232.44
ACD/KOC (pH 5.5): 1719.54
ACD/LogD (pH 7.4): 3.42
ACD/BCF (pH 7.4): 232.44
ACD/KOC (pH 7.4): 1719.56
Polar Surface Area: 82 Å2
Polarizability: 34.2±0.5 10-24cm3
Surface Tension: 52.8±7.0 dyne/cm
Molar Volume: 228.6±7.0 cm3

Click to predict properties on the Chemicalize site


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