Found 22 results

Search term: MF = 'C_{32}H_{31}ClN_{2}O_{7}'
ChemSpider 2D Image | Ethyl 4-[2-{4-[(4-chlorobenzyl)oxy]phenyl}-4-hydroxy-3-(3-hydroxybenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-1-piperidinecarboxylate | C32H31ClN2O7

Ethyl 4-[2-{4-[(4-chlorobenzyl)oxy]phenyl}-4-hydroxy-3-(3-hydroxybenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-1-piperidinecarboxylate

  • Molecular FormulaC32H31ClN2O7
  • Average mass591.051 Da
  • Monoisotopic mass590.182007 Da
  • ChemSpider ID117966109

More details:

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

1-Piperidinecarboxylic acid, 4-[2-[4-[(4-chlorophenyl)methoxy]phenyl]-2,5-dihydro-4-hydroxy-3-(3-hydroxybenzoyl)-5-oxo-1H-pyrrol-1-yl]-, ethyl ester [ACD/Index Name]
4-[2-{4-[(4-Chlorobenzyl)oxy]phényl}-4-hydroxy-3-(3-hydroxybenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-1-pipéridinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-[2-{4-[(4-chlorobenzyl)oxy]phenyl}-4-hydroxy-3-(3-hydroxybenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-1-piperidinecarboxylate [ACD/IUPAC Name]
Ethyl-4-[2-{4-[(4-chlorbenzyl)oxy]phenyl}-4-hydroxy-3-(3-hydroxybenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-1-piperidincarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 797.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 121.6±3.0 kJ/mol
Flash Point: 436.0±32.9 °C
Index of Refraction: 1.655
Molar Refractivity: 155.6±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 4.85
ACD/LogD (pH 5.5): 3.35
ACD/BCF (pH 5.5): 117.10
ACD/KOC (pH 5.5): 532.93
ACD/LogD (pH 7.4): 1.58
ACD/BCF (pH 7.4): 1.98
ACD/KOC (pH 7.4): 9.02
Polar Surface Area: 117 Å2
Polarizability: 61.7±0.5 10-24cm3
Surface Tension: 65.3±3.0 dyne/cm
Molar Volume: 424.1±3.0 cm3

Click to predict properties on the Chemicalize site


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