ChemSpider 2D Image | 5-[2-(Trifluoromethyl)phenyl]-1,2,4-oxadiazole-3-carboxylic acid | C10H5F3N2O3

5-[2-(Trifluoromethyl)phenyl]-1,2,4-oxadiazole-3-carboxylic acid

  • Molecular FormulaC10H5F3N2O3
  • Average mass258.154 Da
  • Monoisotopic mass258.025238 Da
  • ChemSpider ID28546075

More details:

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

1,2,4-Oxadiazole-3-carboxylic acid, 5-[2-(trifluoromethyl)phenyl]- [ACD/Index Name]
5-[2-(Trifluormethyl)phenyl]-1,2,4-oxadiazol-3-carbonsäure [German] [ACD/IUPAC Name]
5-[2-(Trifluoromethyl)phenyl]-1,2,4-oxadiazole-3-carboxylic acid [ACD/IUPAC Name]
Acide 5-[2-(trifluorométhyl)phényl]-1,2,4-oxadiazole-3-carboxylique [French] [ACD/IUPAC Name]
1260640-67-2 [RN]
5-(2-(TRIFLUOROMETHYL)PHENYL)-1,2,4-OXADIAZOLE-3-CARBOXYLIC ACID
MFCD09027680

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

Density: 1.5±0.1 g/cm3
Boiling Point: 398.9±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.5±3.0 kJ/mol
Flash Point: 195.0±30.7 °C
Index of Refraction: 1.515
Molar Refractivity: 51.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.42
ACD/LogD (pH 5.5): -0.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.03
ACD/LogD (pH 7.4): -0.76
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 76 Å2
Polarizability: 20.3±0.5 10-24cm3
Surface Tension: 45.8±3.0 dyne/cm
Molar Volume: 170.0±3.0 cm3

Click to predict properties on the Chemicalize site


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