ChemSpider 2D Image | 1-{3-[3-(Trimethylsilyl)-1-propyn-1-yl]phenyl}-1H-pyrazole-3-carboxylic acid | C16H18N2O2Si

1-{3-[3-(Trimethylsilyl)-1-propyn-1-yl]phenyl}-1H-pyrazole-3-carboxylic acid

  • Molecular FormulaC16H18N2O2Si
  • Average mass298.412 Da
  • Monoisotopic mass298.113739 Da
  • ChemSpider ID93657823

More details:

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

1-{3-[3-(Trimethylsilyl)-1-propin-1-yl]phenyl}-1H-pyrazol-3-carbonsäure [German] [ACD/IUPAC Name]
1-{3-[3-(Trimethylsilyl)-1-propyn-1-yl]phenyl}-1H-pyrazole-3-carboxylic acid [ACD/IUPAC Name]
1H-Pyrazole-3-carboxylic acid, 1-[3-[3-(trimethylsilyl)-1-propyn-1-yl]phenyl]- [ACD/Index Name]
Acide 1-{3-[3-(triméthylsilyl)-1-propyn-1-yl]phényl}-1H-pyrazole-3-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 459.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.9±3.0 kJ/mol
Flash Point: 231.7±25.9 °C
Index of Refraction: 1.545
Molar Refractivity: 88.5±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.04
ACD/LogD (pH 5.5): 2.77
ACD/BCF (pH 5.5): 30.18
ACD/KOC (pH 5.5): 137.26
ACD/LogD (pH 7.4): 1.39
ACD/BCF (pH 7.4): 1.29
ACD/KOC (pH 7.4): 5.86
Polar Surface Area: 55 Å2
Polarizability: 35.1±0.5 10-24cm3
Surface Tension: 34.7±7.0 dyne/cm
Molar Volume: 279.8±7.0 cm3

Click to predict properties on the Chemicalize site


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