Found 25 results

Search term: MF = 'C_{32}H_{27}NO_{5}S'
ChemSpider 2D Image | Methyl 4-{3-(4-ethoxyphenyl)-4-hydroxy-5-oxo-1-[2-(phenylsulfanyl)phenyl]-2,5-dihydro-1H-pyrrol-2-yl}benzoate | C32H27NO5S

Methyl 4-{3-(4-ethoxyphenyl)-4-hydroxy-5-oxo-1-[2-(phenylsulfanyl)phenyl]-2,5-dihydro-1H-pyrrol-2-yl}benzoate

  • Molecular FormulaC32H27NO5S
  • Average mass537.625 Da
  • Monoisotopic mass537.161011 Da
  • ChemSpider ID60288372

More details:

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

4-{3-(4-Éthoxyphényl)-4-hydroxy-5-oxo-1-[2-(phénylsulfanyl)phényl]-2,5-dihydro-1H-pyrrol-2-yl}benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[3-(4-ethoxyphenyl)-2,5-dihydro-4-hydroxy-5-oxo-1-[2-(phenylthio)phenyl]-1H-pyrrol-2-yl]-, methyl ester [ACD/Index Name]
Methyl 4-{3-(4-ethoxyphenyl)-4-hydroxy-5-oxo-1-[2-(phenylsulfanyl)phenyl]-2,5-dihydro-1H-pyrrol-2-yl}benzoate [ACD/IUPAC Name]
Methyl-4-{3-(4-ethoxyphenyl)-4-hydroxy-5-oxo-1-[2-(phenylsulfanyl)phenyl]-2,5-dihydro-1H-pyrrol-2-yl}benzoat [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: 671.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.7±3.0 kJ/mol
Flash Point: 360.0±31.5 °C
Index of Refraction: 1.698
Molar Refractivity: 152.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 7.53
ACD/LogD (pH 5.5): 6.02
ACD/BCF (pH 5.5): 22114.66
ACD/KOC (pH 5.5): 44821.45
ACD/LogD (pH 7.4): 6.01
ACD/BCF (pH 7.4): 21809.18
ACD/KOC (pH 7.4): 44202.30
Polar Surface Area: 101 Å2
Polarizability: 60.4±0.5 10-24cm3
Surface Tension: 68.2±5.0 dyne/cm
Molar Volume: 395.2±5.0 cm3

Click to predict properties on the Chemicalize site


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