ChemSpider 2D Image | 5-(4-Methoxyphenyl)-3-stearoylpyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione | C30H43N3O4

5-(4-Methoxyphenyl)-3-stearoylpyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione

  • Molecular FormulaC30H43N3O4
  • Average mass509.680 Da
  • Monoisotopic mass509.325348 Da
  • ChemSpider ID24673040

More details:

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

5-(4-Methoxyphenyl)-3-stearoylpyrrolo[3,4-c]pyrazol-4,6(1H,5H)-dion [German] [ACD/IUPAC Name]
5-(4-Methoxyphenyl)-3-stearoylpyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione [ACD/IUPAC Name]
5-(4-Méthoxyphényl)-3-stearoylpyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione [French] [ACD/IUPAC Name]
Pyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione, 5-(4-methoxyphenyl)-3-(1-oxooctadecyl)- [ACD/Index 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: 687.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.8±3.0 kJ/mol
Flash Point: 369.8±34.3 °C
Index of Refraction: 1.548
Molar Refractivity: 145.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 2
ACD/LogP: 8.16
ACD/LogD (pH 5.5): 7.94
ACD/BCF (pH 5.5): 535649.13
ACD/KOC (pH 5.5): 355623.22
ACD/LogD (pH 7.4): 6.59
ACD/BCF (pH 7.4): 23587.85
ACD/KOC (pH 7.4): 15660.22
Polar Surface Area: 92 Å2
Polarizability: 57.7±0.5 10-24cm3
Surface Tension: 47.6±3.0 dyne/cm
Molar Volume: 458.0±3.0 cm3

Click to predict properties on the Chemicalize site


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