ChemSpider 2D Image | 1-{[(2S,3R)-3-[2-Chloro(~14~C_6_)phenyl]-2-(4-fluorophenyl)-2-oxiranyl]methyl}-1H-1,2,4-triazole | C1114C6H13ClFN3O

1-{[(2S,3R)-3-[2-Chloro(14C6)phenyl]-2-(4-fluorophenyl)-2-oxiranyl]methyl}-1H-1,2,4-triazole

  • Molecular FormulaC1114C6H13ClFN3O
  • Average mass341.711 Da
  • Monoisotopic mass341.092560 Da
  • ChemSpider ID8792598

  • defined stereocentres - 2 of 2 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

1-{[(2S,3R)-3-[2-Chlor(14C6)phenyl]-2-(4-fluorphenyl)-2-oxiranyl]methyl}-1H-1,2,4-triazol [German] [ACD/IUPAC Name]
1-{[(2S,3R)-3-[2-Chloro(14C6)phenyl]-2-(4-fluorophenyl)-2-oxiranyl]methyl}-1H-1,2,4-triazole [ACD/IUPAC Name]
1-{[(2S,3R)-3-[2-Chloro(14C6)phényl]-2-(4-fluorophényl)-2-oxiranyl]méthyl}-1H-1,2,4-triazole [French] [ACD/IUPAC Name]
1H-1,2,4-Triazole, 1-[[(2S,3R)-3-(2-chlorophenyl-1,2,3,4,5,6-14C6)-2-(4-fluorophenyl)oxiranyl]methyl]- [ACD/Index 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: 1.659
Molar Refractivity: 87.2±0.5 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 34.5±0.5 10-24cm3
Surface Tension: 49.8±7.0 dyne/cm
Molar Volume: 236.5±7.0 cm3

Click to predict properties on the Chemicalize site


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