ChemSpider 2D Image | (4-Nitro-1H-pyrazol-3-yl)[4-(2,2,2-trifluoro-1-hydroxyethyl)-1-piperidinyl]methanone | C11H13F3N4O4

(4-Nitro-1H-pyrazol-3-yl)[4-(2,2,2-trifluoro-1-hydroxyethyl)-1-piperidinyl]methanone

  • Molecular FormulaC11H13F3N4O4
  • Average mass322.241 Da
  • Monoisotopic mass322.088898 Da
  • ChemSpider ID70679057

More details:

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

(4-Nitro-1H-pyrazol-3-yl)[4-(2,2,2-trifluor-1-hydroxyethyl)-1-piperidinyl]methanon [German] [ACD/IUPAC Name]
(4-Nitro-1H-pyrazol-3-yl)[4-(2,2,2-trifluoro-1-hydroxyethyl)-1-piperidinyl]methanone [ACD/IUPAC Name]
(4-Nitro-1H-pyrazol-3-yl)[4-(2,2,2-trifluoro-1-hydroxyéthyl)-1-pipéridinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, (4-nitro-1H-pyrazol-3-yl)[4-(2,2,2-trifluoro-1-hydroxyethyl)-1-piperidinyl]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 564.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.2±3.0 kJ/mol
Flash Point: 295.2±30.1 °C
Index of Refraction: 1.555
Molar Refractivity: 66.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.95
ACD/LogD (pH 5.5): 0.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 30.53
ACD/LogD (pH 7.4): 0.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 28.79
Polar Surface Area: 115 Å2
Polarizability: 26.4±0.5 10-24cm3
Surface Tension: 59.8±3.0 dyne/cm
Molar Volume: 207.4±3.0 cm3

Click to predict properties on the Chemicalize site


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