ChemSpider 2D Image | N-(4-Hydroxy-1,1-dioxidotetrahydro-3-thiophenyl)-N-[(2,4,5-trimethylphenyl)sulfonyl]glycine | C15H21NO7S2

N-(4-Hydroxy-1,1-dioxidotetrahydro-3-thiophenyl)-N-[(2,4,5-trimethylphenyl)sulfonyl]glycine

  • Molecular FormulaC15H21NO7S2
  • Average mass391.460 Da
  • Monoisotopic mass391.075928 Da
  • ChemSpider ID57253979

More details:

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

Glycine, N-(tetrahydro-4-hydroxy-1,1-dioxido-3-thienyl)-N-[(2,4,5-trimethylphenyl)sulfonyl]- [ACD/Index Name]
N-(4-Hydroxy-1,1-dioxidotetrahydro-3-thiophenyl)-N-[(2,4,5-trimethylphenyl)sulfonyl]glycin [German] [ACD/IUPAC Name]
N-(4-Hydroxy-1,1-dioxidotetrahydro-3-thiophenyl)-N-[(2,4,5-trimethylphenyl)sulfonyl]glycine [ACD/IUPAC Name]
N-(4-Hydroxy-1,1-dioxydotétrahydro-3-thiophényl)-N-[(2,4,5-triméthylphényl)sulfonyl]glycine [French] [ACD/IUPAC Name]
MFCD29908162
N-(4-hydroxy-1,1-dioxidotetrahydro-3-thienyl)-N-[(2,4,5-trimethylphenyl)sulfonyl]glycine

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

Density: 1.5±0.1 g/cm3
Boiling Point: 698.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.4±3.0 kJ/mol
Flash Point: 376.3±34.3 °C
Index of Refraction: 1.630
Molar Refractivity: 91.0±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.78
ACD/LogD (pH 5.5): -1.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 146 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 73.8±5.0 dyne/cm
Molar Volume: 255.9±5.0 cm3

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