ChemSpider 2D Image | 4-(Difluoromethoxy)-3,5-dimethyl-N-[2-methyl-3-(4-thiomorpholinylmethyl)phenyl]benzamide | C22H26F2N2O2S

4-(Difluoromethoxy)-3,5-dimethyl-N-[2-methyl-3-(4-thiomorpholinylmethyl)phenyl]benzamide

  • Molecular FormulaC22H26F2N2O2S
  • Average mass420.516 Da
  • Monoisotopic mass420.168304 Da
  • ChemSpider ID31859389

More details:

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

4-(Difluormethoxy)-3,5-dimethyl-N-[2-methyl-3-(4-thiomorpholinylmethyl)phenyl]benzamid [German] [ACD/IUPAC Name]
4-(Difluoromethoxy)-3,5-dimethyl-N-[2-methyl-3-(4-thiomorpholinylmethyl)phenyl]benzamide [ACD/IUPAC Name]
4-(Difluorométhoxy)-3,5-diméthyl-N-[2-méthyl-3-(4-thiomorpholinylméthyl)phényl]benzamide [French] [ACD/IUPAC Name]
Benzamide, 4-(difluoromethoxy)-3,5-dimethyl-N-[2-methyl-3-(4-thiomorpholinylmethyl)phenyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 488.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.4±3.0 kJ/mol
Flash Point: 249.0±28.7 °C
Index of Refraction: 1.598
Molar Refractivity: 115.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.26
ACD/LogD (pH 5.5): 2.89
ACD/BCF (pH 5.5): 40.62
ACD/KOC (pH 5.5): 187.07
ACD/LogD (pH 7.4): 4.23
ACD/BCF (pH 7.4): 893.68
ACD/KOC (pH 7.4): 4116.27
Polar Surface Area: 67 Å2
Polarizability: 45.7±0.5 10-24cm3
Surface Tension: 47.6±3.0 dyne/cm
Molar Volume: 338.3±3.0 cm3

Click to predict properties on the Chemicalize site


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