ChemSpider 2D Image | S-(2-Acetamidoethyl) methanesulfonothioate | C5H11NO3S2

S-(2-Acetamidoethyl) methanesulfonothioate

  • Molecular FormulaC5H11NO3S2
  • Average mass197.276 Da
  • Monoisotopic mass197.018036 Da
  • ChemSpider ID60809061

More details:

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

Méthanesulfonothioate de S-(2-acétamidoéthyle) [French] [ACD/IUPAC Name]
Methanesulfonothioic acid, S-[2-(acetylamino)ethyl] ester [ACD/Index Name]
S-(2-Acetamidoethyl) methanesulfonothioate [ACD/IUPAC Name]
S-(2-Acetamidoethyl)-methansulfonothioat [German] [ACD/IUPAC Name]
88891-66-1 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 480.9±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.6±3.0 kJ/mol
Flash Point: 244.7±24.0 °C
Index of Refraction: 1.514
Molar Refractivity: 45.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.70
ACD/LogD (pH 5.5): -0.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 11.29
ACD/LogD (pH 7.4): -0.60
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 11.29
Polar Surface Area: 97 Å2
Polarizability: 18.2±0.5 10-24cm3
Surface Tension: 47.0±3.0 dyne/cm
Molar Volume: 152.0±3.0 cm3

Click to predict properties on the Chemicalize site


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