ChemSpider 2D Image | 5-[3-Nitro-5-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2(3H)-one | C9H4F3N3O4

5-[3-Nitro-5-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2(3H)-one

  • Molecular FormulaC9H4F3N3O4
  • Average mass275.141 Da
  • Monoisotopic mass275.015381 Da
  • ChemSpider ID82769439

More details:

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

1,3,4-Oxadiazol-2(3H)-one, 5-[3-nitro-5-(trifluoromethyl)phenyl]- [ACD/Index Name]
5-[3-Nitro-5-(trifluormethyl)phenyl]-1,3,4-oxadiazol-2(3H)-on [German] [ACD/IUPAC Name]
5-[3-Nitro-5-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2(3H)-one [ACD/IUPAC Name]
5-[3-Nitro-5-(trifluorométhyl)phényl]-1,3,4-oxadiazol-2(3H)-one [French] [ACD/IUPAC Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.610
Molar Refractivity: 53.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.94
ACD/LogD (pH 5.5): 1.27
ACD/BCF (pH 5.5): 4.54
ACD/KOC (pH 5.5): 83.02
ACD/LogD (pH 7.4): -0.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.66
Polar Surface Area: 97 Å2
Polarizability: 21.0±0.5 10-24cm3
Surface Tension: 55.2±7.0 dyne/cm
Molar Volume: 153.2±7.0 cm3

Click to predict properties on the Chemicalize site


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