ChemSpider 2D Image | Ethyl 2-chloro-3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo(5-~14~C)-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoate | C1414CH14Cl2F3N3O3

Ethyl 2-chloro-3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo(5-14C)-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoate

  • Molecular FormulaC1414CH14Cl2F3N3O3
  • Average mass414.184 Da
  • Monoisotopic mass413.039673 Da
  • ChemSpider ID71048162
  • Non-standard isotope - Non-standard isotope


More details:






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

2-Chloro-3-{2-chloro-5-[4-(difluorométhyl)-3-méthyl-5-oxo(5-14C)-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophényl}propanoate d'éthyle [French] [ACD/IUPAC Name]
Benzenepropanoic acid, α,2-dichloro-5-[4-(difluoromethyl)-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl-5-14C]-4-fluoro-, ethyl ester [ACD/Index Name]
Ethyl 2-chloro-3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo(5-14C)-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoate [ACD/IUPAC Name]
Ethyl-2-chlor-3-{2-chlor-5-[4-(difluormethyl)-3-methyl-5-oxo(5-14C)-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorphenyl}propanoat [German] [ACD/IUPAC Name]
compound 0003970

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.574
Molar Refractivity: 89.1±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: 35.3±0.5 10-24cm3
Surface Tension: 41.6±7.0 dyne/cm
Molar Volume: 269.9±7.0 cm3

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