Found 160 results

Search term: MF = 'C_{25}H_{22}ClNO_{3}S'
ChemSpider 2D Image | 5-(4-Chlorophenyl)-3-hydroxy-4-(4-methoxyphenyl)-1-[4-(methylsulfanyl)benzyl]-1,5-dihydro-2H-pyrrol-2-one | C25H22ClNO3S

5-(4-Chlorophenyl)-3-hydroxy-4-(4-methoxyphenyl)-1-[4-(methylsulfanyl)benzyl]-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC25H22ClNO3S
  • Average mass451.965 Da
  • Monoisotopic mass451.100891 Da
  • ChemSpider ID29036845

More details:

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

2H-Pyrrol-2-one, 5-(4-chlorophenyl)-1,5-dihydro-3-hydroxy-4-(4-methoxyphenyl)-1-[[4-(methylthio)phenyl]methyl]- [ACD/Index Name]
5-(4-Chlorophenyl)-3-hydroxy-4-(4-methoxyphenyl)-1-[4-(methylsulfanyl)benzyl]-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
5-(4-Chlorophényl)-3-hydroxy-4-(4-méthoxyphényl)-1-[4-(méthylsulfanyl)benzyl]-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
5-(4-Chlorphenyl)-3-hydroxy-4-(4-methoxyphenyl)-1-[4-(methylsulfanyl)benzyl]-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
5-(4-chlorophenyl)-3-hydroxy-4-(4-methoxyphenyl)-1-[4-(methylthio)benzyl]-1,5-dihydro-2H-pyrrol-2-one

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

Density: 1.4±0.1 g/cm3
Boiling Point: 667.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 103.1±3.0 kJ/mol
Flash Point: 357.4±31.5 °C
Index of Refraction: 1.692
Molar Refractivity: 126.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 6.11
ACD/LogD (pH 5.5): 5.30
ACD/BCF (pH 5.5): 6306.56
ACD/KOC (pH 5.5): 18259.00
ACD/LogD (pH 7.4): 5.30
ACD/BCF (pH 7.4): 6280.98
ACD/KOC (pH 7.4): 18184.93
Polar Surface Area: 75 Å2
Polarizability: 50.0±0.5 10-24cm3
Surface Tension: 65.1±5.0 dyne/cm
Molar Volume: 329.2±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement