ChemSpider 2D Image | Ethyl N-{(2-methoxyethyl)[3-({[3-(trifluoromethyl)phenyl]sulfonyl}oxy)benzyl]carbamoyl}glycinate | C22H25F3N2O7S

Ethyl N-{(2-methoxyethyl)[3-({[3-(trifluoromethyl)phenyl]sulfonyl}oxy)benzyl]carbamoyl}glycinate

  • Molecular FormulaC22H25F3N2O7S
  • Average mass518.503 Da
  • Monoisotopic mass518.133484 Da
  • ChemSpider ID3789010

More details:

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

Ethyl N-{(2-methoxyethyl)[3-({[3-(trifluoromethyl)phenyl]sulfonyl}oxy)benzyl]carbamoyl}glycinate [ACD/IUPAC Name]
Ethyl-N-{(2-methoxyethyl)[3-({[3-(trifluormethyl)phenyl]sulfonyl}oxy)benzyl]carbamoyl}glycinat [German] [ACD/IUPAC Name]
Glycine, N-[[(2-methoxyethyl)[[3-[[[3-(trifluoromethyl)phenyl]sulfonyl]oxy]phenyl]methyl]amino]carbonyl]-, ethyl ester [ACD/Index Name]
N-{(2-Méthoxyéthyl)[3-({[3-(trifluorométhyl)phényl]sulfonyl}oxy)benzyl]carbamoyl}glycinate d'éthyle [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: 667.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.1±3.0 kJ/mol
Flash Point: 357.5±31.5 °C
Index of Refraction: 1.530
Molar Refractivity: 119.9±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 3.65
ACD/LogD (pH 5.5): 3.52
ACD/BCF (pH 5.5): 279.70
ACD/KOC (pH 5.5): 1963.11
ACD/LogD (pH 7.4): 3.52
ACD/BCF (pH 7.4): 279.65
ACD/KOC (pH 7.4): 1962.76
Polar Surface Area: 120 Å2
Polarizability: 47.5±0.5 10-24cm3
Surface Tension: 44.8±3.0 dyne/cm
Molar Volume: 388.0±3.0 cm3

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