ChemSpider 2D Image | 2-(4-{[3-(Methylsulfonyl)-4-thiomorpholinyl]sulfonyl}-1H-pyrazol-1-yl)ethanamine | C10H18N4O4S3

2-(4-{[3-(Methylsulfonyl)-4-thiomorpholinyl]sulfonyl}-1H-pyrazol-1-yl)ethanamine

  • Molecular FormulaC10H18N4O4S3
  • Average mass354.469 Da
  • Monoisotopic mass354.049011 Da
  • ChemSpider ID49432176

More details:

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

1H-Pyrazole-1-ethanamine, 4-[[3-(methylsulfonyl)-4-thiomorpholinyl]sulfonyl]- [ACD/Index Name]
2-(4-{[3-(Methylsulfonyl)-4-thiomorpholinyl]sulfonyl}-1H-pyrazol-1-yl)ethanamin [German] [ACD/IUPAC Name]
2-(4-{[3-(Methylsulfonyl)-4-thiomorpholinyl]sulfonyl}-1H-pyrazol-1-yl)ethanamine [ACD/IUPAC Name]
2-(4-{[3-(Méthylsulfonyl)-4-thiomorpholinyl]sulfonyl}-1H-pyrazol-1-yl)éthanamine [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 654.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.4±3.0 kJ/mol
Flash Point: 349.6±34.3 °C
Index of Refraction: 1.709
Molar Refractivity: 83.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -1.03
ACD/LogD (pH 5.5): -3.70
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 157 Å2
Polarizability: 33.1±0.5 10-24cm3
Surface Tension: 75.3±7.0 dyne/cm
Molar Volume: 214.0±7.0 cm3

Click to predict properties on the Chemicalize site


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