Found 1377 results

Search term: MF = 'C_{15}H_{16}ClN_{3}O_{4}'
ChemSpider 2D Image | Diethyl 4-amino-1-(3-chlorophenyl)-1H-pyrazole-3,5-dicarboxylate | C15H16ClN3O4

Diethyl 4-amino-1-(3-chlorophenyl)-1H-pyrazole-3,5-dicarboxylate

  • Molecular FormulaC15H16ClN3O4
  • Average mass337.758 Da
  • Monoisotopic mass337.082947 Da
  • ChemSpider ID22763893

More details:

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

1H-Pyrazole-3,5-dicarboxylic acid, 4-amino-1-(3-chlorophenyl)-, diethyl ester [ACD/Index Name]
4-Amino-1-(3-chlorophényl)-1H-pyrazole-3,5-dicarboxylate de diéthyle [French] [ACD/IUPAC Name]
Diethyl 4-amino-1-(3-chlorophenyl)-1H-pyrazole-3,5-dicarboxylate [ACD/IUPAC Name]
Diethyl-4-amino-1-(3-chlorphenyl)-1H-pyrazol-3,5-dicarboxylat [German] [ACD/IUPAC Name]
4-Amino-1-(3-chloro-phenyl)-1H-pyrazole-3,5-dicarboxylic acid diethyl ester
ethyl 4-amino-1-(3-chlorophenyl)-3-(ethoxycarbonyl)pyrazole-5-carboxylate
ethyl 4-amino-1-(3-chlorophenyl)-5-(ethoxycarbonyl)pyrazole-3-carboxylate

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

Density: 1.4±0.1 g/cm3
Boiling Point: 462.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.3±3.0 kJ/mol
Flash Point: 233.5±28.7 °C
Index of Refraction: 1.605
Molar Refractivity: 84.2±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.01
ACD/LogD (pH 5.5): 3.98
ACD/BCF (pH 5.5): 620.16
ACD/KOC (pH 5.5): 3471.17
ACD/LogD (pH 7.4): 3.98
ACD/BCF (pH 7.4): 620.16
ACD/KOC (pH 7.4): 3471.17
Polar Surface Area: 96 Å2
Polarizability: 33.4±0.5 10-24cm3
Surface Tension: 49.5±7.0 dyne/cm
Molar Volume: 244.5±7.0 cm3

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