ChemSpider 2D Image | Methyl N-[(4-chlorophenyl)sulfonyl]-L-methioninate | C12H16ClNO4S2

Methyl N-[(4-chlorophenyl)sulfonyl]-L-methioninate

  • Molecular FormulaC12H16ClNO4S2
  • Average mass337.843 Da
  • Monoisotopic mass337.020935 Da
  • ChemSpider ID24742403

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

L-Methionine, N-[(4-chlorophenyl)sulfonyl]-, methyl ester [ACD/Index Name]
Methyl N-[(4-chlorophenyl)sulfonyl]-L-methioninate [ACD/IUPAC Name]
Methyl-N-[(4-chlorphenyl)sulfonyl]-L-methioninat [German] [ACD/IUPAC Name]
N-[(4-Chlorophényl)sulfonyl]-L-méthioninate de méthyle [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: 483.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.9±3.0 kJ/mol
Flash Point: 246.4±31.5 °C
Index of Refraction: 1.561
Molar Refractivity: 81.7±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.42
ACD/LogD (pH 5.5): 2.86
ACD/BCF (pH 5.5): 88.36
ACD/KOC (pH 5.5): 860.06
ACD/LogD (pH 7.4): 2.81
ACD/BCF (pH 7.4): 77.71
ACD/KOC (pH 7.4): 756.38
Polar Surface Area: 106 Å2
Polarizability: 32.4±0.5 10-24cm3
Surface Tension: 48.2±3.0 dyne/cm
Molar Volume: 252.3±3.0 cm3

Click to predict properties on the Chemicalize site


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