ChemSpider 2D Image | MFCD08446030 | C19H17BrN2O2

MFCD08446030

  • Molecular FormulaC19H17BrN2O2
  • Average mass385.254 Da
  • Monoisotopic mass384.047333 Da
  • ChemSpider ID21498801

More details:

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

1-Benzyl-3-(4-bromophényl)-1H-pyrazole-5-carboxylate d'éthyle [French] [ACD/IUPAC Name]
1H-Pyrazole-5-carboxylic acid, 3-(4-bromophenyl)-1-(phenylmethyl)-, ethyl ester [ACD/Index Name]
948293-14-9 [RN]
Ethyl 1-benzyl-3-(4-bromophenyl)-1H-pyrazole-5-carboxylate [ACD/IUPAC Name]
Ethyl 3-(4-bromophenyl)-1-(phenylmethyl)-1H-pyrazole-5-carboxylate
Ethyl-1-benzyl-3-(4-bromphenyl)-1H-pyrazol-5-carboxylat [German] [ACD/IUPAC Name]
MFCD08446030
[948293-14-9] [RN]
1H-pyrazole-5-carboxylate
Ethyl 1-Benzyl-3-(4-bromophenyl)-
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 528.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.3±3.0 kJ/mol
Flash Point: 273.2±30.1 °C
Index of Refraction: 1.615
Molar Refractivity: 99.1±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.90
ACD/LogD (pH 5.5): 5.14
ACD/BCF (pH 5.5): 4727.54
ACD/KOC (pH 5.5): 14855.81
ACD/LogD (pH 7.4): 5.14
ACD/BCF (pH 7.4): 4727.54
ACD/KOC (pH 7.4): 14855.83
Polar Surface Area: 44 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 45.8±7.0 dyne/cm
Molar Volume: 283.9±7.0 cm3

Click to predict properties on the Chemicalize site


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