ChemSpider 2D Image | 5-Chloro-4-[(3,5-dimethyladamantan-1-yl)methoxy]-2-fluoro-N-(methylsulfonyl)benzamide | C21H27ClFNO4S

5-Chloro-4-[(3,5-dimethyladamantan-1-yl)methoxy]-2-fluoro-N-(methylsulfonyl)benzamide

  • Molecular FormulaC21H27ClFNO4S
  • Average mass443.960 Da
  • Monoisotopic mass443.133331 Da
  • ChemSpider ID76825713

More details:

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

5-Chlor-4-[(3,5-dimethyladamantan-1-yl)methoxy]-2-fluor-N-(methylsulfonyl)benzamid [German] [ACD/IUPAC Name]
5-Chloro-4-[(3,5-dimethyladamantan-1-yl)methoxy]-2-fluoro-N-(methylsulfonyl)benzamide [ACD/IUPAC Name]
5-Chloro-4-[(3,5-diméthyladamantan-1-yl)méthoxy]-2-fluoro-N-(méthylsulfonyl)benzamide [French] [ACD/IUPAC Name]
Benzamide, 5-chloro-4-[(3,5-dimethyltricyclo[3.3.1.13,7]dec-1-yl)methoxy]-2-fluoro-N-(methylsulfonyl)- [ACD/Index 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.575
Molar Refractivity: 109.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.33
ACD/LogD (pH 5.5): 2.91
ACD/BCF (pH 5.5): 33.48
ACD/KOC (pH 5.5): 123.83
ACD/LogD (pH 7.4): 2.81
ACD/BCF (pH 7.4): 26.73
ACD/KOC (pH 7.4): 98.86
Polar Surface Area: 81 Å2
Polarizability: 43.3±0.5 10-24cm3
Surface Tension: 55.2±3.0 dyne/cm
Molar Volume: 330.7±3.0 cm3

Click to predict properties on the Chemicalize site


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