Found 22 results

Search term: MF = 'C_{32}H_{31}ClN_{2}O_{7}'
ChemSpider 2D Image | Isopropyl 4-{[3-(4-butylbenzoyl)-2-(4-chloro-3-nitrophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]methyl}benzoate | C32H31ClN2O7

Isopropyl 4-{[3-(4-butylbenzoyl)-2-(4-chloro-3-nitrophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]methyl}benzoate

  • Molecular FormulaC32H31ClN2O7
  • Average mass591.051 Da
  • Monoisotopic mass590.182007 Da
  • ChemSpider ID118236186

More details:

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

4-{[3-(4-Butylbenzoyl)-2-(4-chloro-3-nitrophényl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]méthyl}benzoate d'isopropyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[[3-(4-butylbenzoyl)-2-(4-chloro-3-nitrophenyl)-2,5-dihydro-4-hydroxy-5-oxo-1H-pyrrol-1-yl]methyl]-, 1-methylethyl ester [ACD/Index Name]
Isopropyl 4-{[3-(4-butylbenzoyl)-2-(4-chloro-3-nitrophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]methyl}benzoate [ACD/IUPAC Name]
Isopropyl-4-{[3-(4-butylbenzoyl)-2-(4-chlor-3-nitrophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]methyl}benzoat [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: 755.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 115.5±3.0 kJ/mol
Flash Point: 410.8±32.9 °C
Index of Refraction: 1.631
Molar Refractivity: 157.8±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 7.62
ACD/LogD (pH 5.5): 5.32
ACD/BCF (pH 5.5): 3627.24
ACD/KOC (pH 5.5): 6222.33
ACD/LogD (pH 7.4): 3.55
ACD/BCF (pH 7.4): 62.57
ACD/KOC (pH 7.4): 107.34
Polar Surface Area: 130 Å2
Polarizability: 62.6±0.5 10-24cm3
Surface Tension: 59.2±3.0 dyne/cm
Molar Volume: 442.9±3.0 cm3

Click to predict properties on the Chemicalize site


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