ChemSpider 2D Image | 3-[(4-Bromo-1,3-diethyl-1H-pyrazol-5-yl)methoxy]-2,2-dimethyl-1-propanol | C13H23BrN2O2

3-[(4-Bromo-1,3-diethyl-1H-pyrazol-5-yl)methoxy]-2,2-dimethyl-1-propanol

  • Molecular FormulaC13H23BrN2O2
  • Average mass319.238 Da
  • Monoisotopic mass318.094269 Da
  • ChemSpider ID37400427

More details:

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

1-Propanol, 3-[(4-bromo-1,3-diethyl-1H-pyrazol-5-yl)methoxy]-2,2-dimethyl- [ACD/Index Name]
3-[(4-Brom-1,3-diethyl-1H-pyrazol-5-yl)methoxy]-2,2-dimethyl-1-propanol [German] [ACD/IUPAC Name]
3-[(4-Bromo-1,3-diethyl-1H-pyrazol-5-yl)methoxy]-2,2-dimethyl-1-propanol [ACD/IUPAC Name]
3-[(4-Bromo-1,3-diéthyl-1H-pyrazol-5-yl)méthoxy]-2,2-diméthyl-1-propanol [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 421.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.2±3.0 kJ/mol
Flash Point: 208.6±27.3 °C
Index of Refraction: 1.531
Molar Refractivity: 76.5±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.96
ACD/LogD (pH 5.5): 3.20
ACD/BCF (pH 5.5): 159.32
ACD/KOC (pH 5.5): 1312.17
ACD/LogD (pH 7.4): 3.20
ACD/BCF (pH 7.4): 159.32
ACD/KOC (pH 7.4): 1312.18
Polar Surface Area: 47 Å2
Polarizability: 30.3±0.5 10-24cm3
Surface Tension: 36.8±7.0 dyne/cm
Molar Volume: 247.2±7.0 cm3

Click to predict properties on the Chemicalize site


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