ChemSpider 2D Image | 2-[5-Chloro-2-(2-thienyl)-1H-indol-1-yl]-N-cyclooctylacetamide | C22H25ClN2OS

2-[5-Chloro-2-(2-thienyl)-1H-indol-1-yl]-N-cyclooctylacetamide

  • Molecular FormulaC22H25ClN2OS
  • Average mass400.965 Da
  • Monoisotopic mass400.137604 Da
  • ChemSpider ID29008182

More details:

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

1H-Indole-1-acetamide, 5-chloro-N-cyclooctyl-2-(2-thienyl)- [ACD/Index Name]
2-[5-Chlor-2-(2-thienyl)-1H-indol-1-yl]-N-cyclooctylacetamid [German] [ACD/IUPAC Name]
2-[5-Chloro-2-(2-thienyl)-1H-indol-1-yl]-N-cyclooctylacetamide [ACD/IUPAC Name]
2-[5-Chloro-2-(2-thiényl)-1H-indol-1-yl]-N-cyclooctylacétamide [French] [ACD/IUPAC Name]
2-[5-CHLORO-2-(THIOPHEN-2-YL)-1H-INDOL-1-YL]-N-CYCLOOCTYLACETAMIDE
2-[5-CHLORO-2-(THIOPHEN-2-YL)INDOL-1-YL]-N-CYCLOOCTYLACETAMIDE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 629.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.1±3.0 kJ/mol
Flash Point: 334.5±30.1 °C
Index of Refraction: 1.659
Molar Refractivity: 114.0±0.5 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 6.77
ACD/LogD (pH 5.5): 6.16
ACD/BCF (pH 5.5): 28079.45
ACD/KOC (pH 5.5): 53179.15
ACD/LogD (pH 7.4): 6.16
ACD/BCF (pH 7.4): 28079.45
ACD/KOC (pH 7.4): 53179.15
Polar Surface Area: 62 Å2
Polarizability: 45.2±0.5 10-24cm3
Surface Tension: 50.1±7.0 dyne/cm
Molar Volume: 309.2±7.0 cm3

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