ChemSpider 2D Image | 4-(4-Methoxyphenyl)-3-(5-tetrazolidinyl)-6-[4-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)-5,6-dihydro-2(1H)-pyridinone | C22H21F6N5O3

4-(4-Methoxyphenyl)-3-(5-tetrazolidinyl)-6-[4-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)-5,6-dihydro-2(1H)-pyridinone

  • Molecular FormulaC22H21F6N5O3
  • Average mass517.424 Da
  • Monoisotopic mass517.154846 Da
  • ChemSpider ID61748768

More details:

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

2(1H)-Pyridinone, 5,6-dihydro-4-(4-methoxyphenyl)-3-(5-tetrazolidinyl)-6-[4-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)- [ACD/Index Name]
4-(4-Methoxyphenyl)-3-(5-tetrazolidinyl)-6-[4-(2,2,2-trifluorethoxy)phenyl]-6-(trifluormethyl)-5,6-dihydro-2(1H)-pyridinon [German] [ACD/IUPAC Name]
4-(4-Methoxyphenyl)-3-(5-tetrazolidinyl)-6-[4-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)-5,6-dihydro-2(1H)-pyridinone [ACD/IUPAC Name]
4-(4-Méthoxyphényl)-3-(5-tétrazolidinyl)-6-[4-(2,2,2-trifluoroéthoxy)phényl]-6-(trifluorométhyl)-5,6-dihydro-2(1H)-pyridinone [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: 1.520
Molar Refractivity: 114.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 5.34
ACD/LogD (pH 5.5): 2.52
ACD/BCF (pH 5.5): 28.32
ACD/KOC (pH 5.5): 202.51
ACD/LogD (pH 7.4): 3.44
ACD/BCF (pH 7.4): 237.03
ACD/KOC (pH 7.4): 1695.12
Polar Surface Area: 96 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 36.7±3.0 dyne/cm
Molar Volume: 375.5±3.0 cm3

Click to predict properties on the Chemicalize site


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