ChemSpider 2D Image | 1-(4-Chloro-1,1-dioxidotetrahydro-3-thiophenyl)-3-methylurea | C6H11ClN2O3S

1-(4-Chloro-1,1-dioxidotetrahydro-3-thiophenyl)-3-methylurea

  • Molecular FormulaC6H11ClN2O3S
  • Average mass226.681 Da
  • Monoisotopic mass226.017883 Da
  • ChemSpider ID41274442

More details:

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

1-(4-Chlor-1,1-dioxidotetrahydro-3-thiophenyl)-3-methylharnstoff [German] [ACD/IUPAC Name]
1-(4-Chloro-1,1-dioxidotetrahydro-3-thiophenyl)-3-methylurea [ACD/IUPAC Name]
1-(4-Chloro-1,1-dioxydotétrahydro-3-thiophényl)-3-méthylurée [French] [ACD/IUPAC Name]
Urea, N-(4-chlorotetrahydro-1,1-dioxido-3-thienyl)-N'-methyl- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 579.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.6±3.0 kJ/mol
Flash Point: 304.0±30.1 °C
Index of Refraction: 1.543
Molar Refractivity: 48.8±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -2.00
ACD/LogD (pH 5.5): -1.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.72
ACD/LogD (pH 7.4): -1.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.72
Polar Surface Area: 84 Å2
Polarizability: 19.3±0.5 10-24cm3
Surface Tension: 52.5±5.0 dyne/cm
Molar Volume: 154.8±5.0 cm3

Click to predict properties on the Chemicalize site


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