Found 96 results

Search term: MF = 'C_{23}H_{25}NO_{2}S_{2}'
ChemSpider 2D Image | 3-(Benzylsulfanyl)-1-cyclooctyl-4-(2-thienyl)-1H-pyrrole-2,5-dione | C23H25NO2S2

3-(Benzylsulfanyl)-1-cyclooctyl-4-(2-thienyl)-1H-pyrrole-2,5-dione

  • Molecular FormulaC23H25NO2S2
  • Average mass411.580 Da
  • Monoisotopic mass411.132660 Da
  • ChemSpider ID32252737

More details:

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

1H-Pyrrole-2,5-dione, 1-cyclooctyl-3-[(phenylmethyl)thio]-4-(2-thienyl)- [ACD/Index Name]
3-(Benzylsulfanyl)-1-cyclooctyl-4-(2-thienyl)-1H-pyrrol-2,5-dion [German] [ACD/IUPAC Name]
3-(Benzylsulfanyl)-1-cyclooctyl-4-(2-thienyl)-1H-pyrrole-2,5-dione [ACD/IUPAC Name]
3-(Benzylsulfanyl)-1-cyclooctyl-4-(2-thiényl)-1H-pyrrole-2,5-dione [French] [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: 569.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.4±3.0 kJ/mol
Flash Point: 298.0±30.1 °C
Index of Refraction: 1.648
Molar Refractivity: 117.3±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 7.03
ACD/LogD (pH 5.5): 6.03
ACD/BCF (pH 5.5): 22741.43
ACD/KOC (pH 5.5): 45729.43
ACD/LogD (pH 7.4): 6.03
ACD/BCF (pH 7.4): 22741.43
ACD/KOC (pH 7.4): 45729.43
Polar Surface Area: 91 Å2
Polarizability: 46.5±0.5 10-24cm3
Surface Tension: 58.4±5.0 dyne/cm
Molar Volume: 322.5±5.0 cm3

Click to predict properties on the Chemicalize site


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