ChemSpider 2D Image | 3-(3,5-Dimethyl-1H-pyrazol-4-yl)-1-propanol | C8H14N2O

3-(3,5-Dimethyl-1H-pyrazol-4-yl)-1-propanol

  • Molecular FormulaC8H14N2O
  • Average mass154.210 Da
  • Monoisotopic mass154.110611 Da
  • ChemSpider ID49621569

More details:

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

1H-Pyrazole-4-propanol, 3,5-dimethyl- [ACD/Index Name]
3-(3,5-Dimethyl-1H-pyrazol-4-yl)-1-propanol [German] [ACD/IUPAC Name]
3-(3,5-Dimethyl-1H-pyrazol-4-yl)-1-propanol [ACD/IUPAC Name]
3-(3,5-Diméthyl-1H-pyrazol-4-yl)-1-propanol [French] [ACD/IUPAC Name]
1779428-05-5 [RN]
3-(3,5-dimethyl-1H-pyrazol-4-yl)propan-1-ol

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

Density: 1.1±0.1 g/cm3
Boiling Point: 344.0±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.0±3.0 kJ/mol
Flash Point: 161.9±26.5 °C
Index of Refraction: 1.542
Molar Refractivity: 44.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.90
ACD/LogD (pH 5.5): 1.08
ACD/BCF (pH 5.5): 3.78
ACD/KOC (pH 5.5): 86.57
ACD/LogD (pH 7.4): 1.14
ACD/BCF (pH 7.4): 4.35
ACD/KOC (pH 7.4): 99.66
Polar Surface Area: 49 Å2
Polarizability: 17.5±0.5 10-24cm3
Surface Tension: 48.0±3.0 dyne/cm
Molar Volume: 140.4±3.0 cm3

Click to predict properties on the Chemicalize site


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