Found 160 results

Search term: MF = 'C_{25}H_{22}ClNO_{3}S'
ChemSpider 2D Image | 2-[2-(Benzyloxy)-5-chlorophenyl]-5-methyl-1-[3-(methylsulfonyl)phenyl]-1H-pyrrole | C25H22ClNO3S

2-[2-(Benzyloxy)-5-chlorophenyl]-5-methyl-1-[3-(methylsulfonyl)phenyl]-1H-pyrrole

  • Molecular FormulaC25H22ClNO3S
  • Average mass451.965 Da
  • Monoisotopic mass451.100891 Da
  • ChemSpider ID23294572

More details:

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

1H-Pyrrole, 2-[5-chloro-2-(phenylmethoxy)phenyl]-5-methyl-1-[3-(methylsulfonyl)phenyl]- [ACD/Index Name]
2-[2-(Benzyloxy)-5-chlorophenyl]-5-methyl-1-[3-(methylsulfonyl)phenyl]-1H-pyrrole [ACD/IUPAC Name]
2-[2-(Benzyloxy)-5-chlorophényl]-5-méthyl-1-[3-(méthylsulfonyl)phényl]-1H-pyrrole [French] [ACD/IUPAC Name]
2-[2-(Benzyloxy)-5-chlorphenyl]-5-methyl-1-[3-(methylsulfonyl)phenyl]-1H-pyrrol [German] [ACD/IUPAC Name]
2-(2-(benzyloxy)-5-chlorophenyl)-5-methyl-1-(3-(methylsulfonyl)phenyl)-1H-pyrrole

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

Density: 1.2±0.1 g/cm3
Boiling Point: 633.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.2±3.0 kJ/mol
Flash Point: 336.8±31.5 °C
Index of Refraction: 1.610
Molar Refractivity: 126.9±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.71
ACD/LogD (pH 5.5): 5.76
ACD/BCF (pH 5.5): 14017.35
ACD/KOC (pH 5.5): 32342.37
ACD/LogD (pH 7.4): 5.76
ACD/BCF (pH 7.4): 14017.35
ACD/KOC (pH 7.4): 32342.37
Polar Surface Area: 57 Å2
Polarizability: 50.3±0.5 10-24cm3
Surface Tension: 45.2±7.0 dyne/cm
Molar Volume: 365.8±7.0 cm3

Click to predict properties on the Chemicalize site


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