ChemSpider 2D Image | N-({2-[(Ethylsulfonyl)amino]ethyl}sulfonyl)-N-methylalanine | C8H18N2O6S2

N-({2-[(Ethylsulfonyl)amino]ethyl}sulfonyl)-N-methylalanine

  • Molecular FormulaC8H18N2O6S2
  • Average mass302.368 Da
  • Monoisotopic mass302.060638 Da
  • ChemSpider ID54272181

More details:






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

Alanine, N-[[2-[(ethylsulfonyl)amino]ethyl]sulfonyl]-N-methyl- [ACD/Index Name]
N-({2-[(Ethylsulfonyl)amino]ethyl}sulfonyl)-N-methylalanin [German] [ACD/IUPAC Name]
N-({2-[(Ethylsulfonyl)amino]ethyl}sulfonyl)-N-methylalanine [ACD/IUPAC Name]
N-({2-[(Éthylsulfonyl)amino]éthyl}sulfonyl)-N-méthylalanine [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 500.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 84.2±6.0 kJ/mol
Flash Point: 256.5±32.9 °C
Index of Refraction: 1.529
Molar Refractivity: 65.9±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: -0.52
ACD/LogD (pH 5.5): -2.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 138 Å2
Polarizability: 26.1±0.5 10-24cm3
Surface Tension: 57.9±3.0 dyne/cm
Molar Volume: 213.7±3.0 cm3

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