ChemSpider 2D Image | Methyl N-({[2-methyl-5-(methylsulfonyl)benzoyl]oxy}acetyl)leucinate | C18H25NO7S

Methyl N-({[2-methyl-5-(methylsulfonyl)benzoyl]oxy}acetyl)leucinate

  • Molecular FormulaC18H25NO7S
  • Average mass399.459 Da
  • Monoisotopic mass399.135162 Da
  • ChemSpider ID22548937

More details:

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

Leucine, N-[2-[[2-methyl-5-(methylsulfonyl)benzoyl]oxy]acetyl]-, methyl ester [ACD/Index Name]
Methyl N-({[2-methyl-5-(methylsulfonyl)benzoyl]oxy}acetyl)leucinate [ACD/IUPAC Name]
Methyl-N-({[2-methyl-5-(methylsulfonyl)benzoyl]oxy}acetyl)leucinat [German] [ACD/IUPAC Name]
N-(2-{[2-Méthyl-5-(méthylsulfonyl)benzoyl]oxy}acétyl)leucinate de méthyle [French] [ACD/IUPAC 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: 612.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.9±3.0 kJ/mol
Flash Point: 324.1±31.5 °C
Index of Refraction: 1.514
Molar Refractivity: 98.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.08
ACD/LogD (pH 5.5): 2.00
ACD/BCF (pH 5.5): 19.33
ACD/KOC (pH 5.5): 289.93
ACD/LogD (pH 7.4): 2.00
ACD/BCF (pH 7.4): 19.33
ACD/KOC (pH 7.4): 289.92
Polar Surface Area: 124 Å2
Polarizability: 39.1±0.5 10-24cm3
Surface Tension: 43.4±3.0 dyne/cm
Molar Volume: 327.6±3.0 cm3

Click to predict properties on the Chemicalize site


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