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ChemSpider 2D Image | Benzyl 1H-pyrazole-4-carboxylate | C11H10N2O2

Benzyl 1H-pyrazole-4-carboxylate

  • Molecular FormulaC11H10N2O2
  • Average mass202.209 Da
  • Monoisotopic mass202.074234 Da
  • ChemSpider ID127430504

More details:

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

1H-Pyrazole-4-carboxylate de benzyle [French] [ACD/IUPAC Name]
1H-Pyrazole-4-carboxylic acid, phenylmethyl ester [ACD/Index Name]
Benzyl 1H-pyrazole-4-carboxylate [ACD/IUPAC Name]
Benzyl-1H-pyrazol-4-carboxylat [German] [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: 391.5±17.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.1±3.0 kJ/mol
Flash Point: 190.6±20.9 °C
Index of Refraction: 1.606
Molar Refractivity: 55.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.49
ACD/LogD (pH 5.5): 2.31
ACD/BCF (pH 5.5): 33.69
ACD/KOC (pH 5.5): 431.49
ACD/LogD (pH 7.4): 2.31
ACD/BCF (pH 7.4): 33.69
ACD/KOC (pH 7.4): 431.46
Polar Surface Area: 55 Å2
Polarizability: 21.8±0.5 10-24cm3
Surface Tension: 56.8±3.0 dyne/cm
Molar Volume: 159.6±3.0 cm3

Click to predict properties on the Chemicalize site


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