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Search term: KZCUBZWSXXCEFP (Found by InChIKey (skeleton match))
ChemSpider 2D Image | Methyl 1-{[3-(methoxycarbonyl)-1-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-5-yl]carbonyl}-L-prolinate | C19H23N3O5

Methyl 1-{[3-(methoxycarbonyl)-1-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-5-yl]carbonyl}-L-prolinate

  • Molecular FormulaC19H23N3O5
  • Average mass373.403 Da
  • Monoisotopic mass373.163757 Da
  • ChemSpider ID30650309

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

1-{[3-(Méthoxycarbonyl)-1-(4-méthylphényl)-4,5-dihydro-1H-pyrazol-5-yl]carbonyl}-L-prolinate de méthyle [French] [ACD/IUPAC Name]
L-Proline, 1-[[4,5-dihydro-3-(methoxycarbonyl)-1-(4-methylphenyl)-1H-pyrazol-5-yl]carbonyl]-, methyl ester [ACD/Index Name]
Methyl 1-{[3-(methoxycarbonyl)-1-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-5-yl]carbonyl}-L-prolinate [ACD/IUPAC Name]
Methyl-1-{[3-(methoxycarbonyl)-1-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-5-yl]carbonyl}-L-prolinat [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: 543.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.2±3.0 kJ/mol
Flash Point: 282.4±32.9 °C
Index of Refraction: 1.615
Molar Refractivity: 98.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.54
ACD/LogD (pH 5.5): 1.88
ACD/BCF (pH 5.5): 15.70
ACD/KOC (pH 5.5): 249.89
ACD/LogD (pH 7.4): 1.88
ACD/BCF (pH 7.4): 15.70
ACD/KOC (pH 7.4): 249.89
Polar Surface Area: 89 Å2
Polarizability: 38.9±0.5 10-24cm3
Surface Tension: 49.0±7.0 dyne/cm
Molar Volume: 281.3±7.0 cm3

Click to predict properties on the Chemicalize site


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