ChemSpider 2D Image | 1-{3-[2-Chloro-5-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methanamine | C10H7ClF3N3O

1-{3-[2-Chloro-5-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methanamine

  • Molecular FormulaC10H7ClF3N3O
  • Average mass277.630 Da
  • Monoisotopic mass277.022980 Da
  • ChemSpider ID27109120

More details:

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

1,2,4-Oxadiazole-5-methanamine, 3-[2-chloro-5-(trifluoromethyl)phenyl]- [ACD/Index Name]
1-{3-[2-Chlor-5-(trifluormethyl)phenyl]-1,2,4-oxadiazol-5-yl}methanamin [German] [ACD/IUPAC Name]
1-{3-[2-Chloro-5-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methanamine [ACD/IUPAC Name]
1-{3-[2-Chloro-5-(trifluorométhyl)phényl]-1,2,4-oxadiazol-5-yl}méthanamine [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 360.6±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.6±3.0 kJ/mol
Flash Point: 171.9±30.7 °C
Index of Refraction: 1.521
Molar Refractivity: 57.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.84
ACD/LogD (pH 5.5): 1.41
ACD/BCF (pH 5.5): 4.87
ACD/KOC (pH 5.5): 70.80
ACD/LogD (pH 7.4): 2.04
ACD/BCF (pH 7.4): 20.73
ACD/KOC (pH 7.4): 301.16
Polar Surface Area: 65 Å2
Polarizability: 22.9±0.5 10-24cm3
Surface Tension: 41.9±3.0 dyne/cm
Molar Volume: 189.4±3.0 cm3

Click to predict properties on the Chemicalize site


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