ChemSpider 2D Image | 3-(sec-Butoxymethyl)-1-(3,3,3-trifluoropropyl)-1H-pyrazole | C11H17F3N2O

3-(sec-Butoxymethyl)-1-(3,3,3-trifluoropropyl)-1H-pyrazole

  • Molecular FormulaC11H17F3N2O
  • Average mass250.261 Da
  • Monoisotopic mass250.129303 Da
  • ChemSpider ID53606661

More details:

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

1H-Pyrazole, 3-[(1-methylpropoxy)methyl]-1-(3,3,3-trifluoropropyl)- [ACD/Index Name]
3-(sec-Butoxymethyl)-1-(3,3,3-trifluoropropyl)-1H-pyrazole [ACD/IUPAC Name]
3-(sec-Butoxyméthyl)-1-(3,3,3-trifluoropropyl)-1H-pyrazole [French] [ACD/IUPAC Name]
3-(sec-Butoxymethyl)-1-(3,3,3-trifluorpropyl)-1H-pyrazol [German] [ACD/IUPAC Name]
1856041-01-4 [RN]
MFCD29910591

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

Density: 1.2±0.1 g/cm3
Boiling Point: 263.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.1±3.0 kJ/mol
Flash Point: 113.2±27.3 °C
Index of Refraction: 1.458
Molar Refractivity: 58.9±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.50
ACD/LogD (pH 5.5): 2.76
ACD/BCF (pH 5.5): 73.07
ACD/KOC (pH 5.5): 751.05
ACD/LogD (pH 7.4): 2.76
ACD/BCF (pH 7.4): 73.08
ACD/KOC (pH 7.4): 751.10
Polar Surface Area: 27 Å2
Polarizability: 23.3±0.5 10-24cm3
Surface Tension: 28.4±7.0 dyne/cm
Molar Volume: 215.6±7.0 cm3

Click to predict properties on the Chemicalize site


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