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Search term: GGUBULNJTWFONN-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | S-(1-Hydroxy-2,2,5,5-tetramethyl-2,5-dihydro-1H-imidazol-4-yl) methanesulfonothioate | C8H16N2O3S2

S-(1-Hydroxy-2,2,5,5-tetramethyl-2,5-dihydro-1H-imidazol-4-yl) methanesulfonothioate

  • Molecular FormulaC8H16N2O3S2
  • Average mass252.354 Da
  • Monoisotopic mass252.060226 Da
  • ChemSpider ID59052714

More details:

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

Méthanesulfonothioate de S-(1-hydroxy-2,2,5,5-tétraméthyl-2,5-dihydro-1H-imidazol-4-yle) [French] [ACD/IUPAC Name]
Methanesulfonothioic acid, S-(2,5-dihydro-1-hydroxy-2,2,5,5-tetramethyl-1H-imidazol-4-yl) ester [ACD/Index Name]
S-(1-Hydroxy-2,2,5,5-tetramethyl-2,5-dihydro-1H-imidazol-4-yl) methanesulfonothioate [ACD/IUPAC Name]
S-(1-Hydroxy-2,2,5,5-tetramethyl-2,5-dihydro-1H-imidazol-4-yl)-methansulfonothioat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 385.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 69.7±6.0 kJ/mol
Flash Point: 187.2±28.7 °C
Index of Refraction: 1.583
Molar Refractivity: 62.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.78
ACD/LogD (pH 5.5): -0.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.78
ACD/LogD (pH 7.4): -0.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 15.08
Polar Surface Area: 104 Å2
Polarizability: 24.7±0.5 10-24cm3
Surface Tension: 47.6±7.0 dyne/cm
Molar Volume: 186.9±7.0 cm3

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