ChemSpider 2D Image | 1-(1,1-Dioxidotetrahydro-3-thiophenyl)-1-ethyl-3-(3-fluorobenzyl)thiourea | C14H19FN2O2S2

1-(1,1-Dioxidotetrahydro-3-thiophenyl)-1-ethyl-3-(3-fluorobenzyl)thiourea

  • Molecular FormulaC14H19FN2O2S2
  • Average mass330.441 Da
  • Monoisotopic mass330.087189 Da
  • ChemSpider ID60461268

More details:

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

1-(1,1-Dioxidotetrahydro-3-thiophenyl)-1-ethyl-3-(3-fluorbenzyl)thioharnstoff [German] [ACD/IUPAC Name]
1-(1,1-Dioxidotetrahydro-3-thiophenyl)-1-ethyl-3-(3-fluorobenzyl)thiourea [ACD/IUPAC Name]
1-(1,1-Dioxydotétrahydro-3-thiophényl)-1-éthyl-3-(3-fluorobenzyl)thiourée [French] [ACD/IUPAC Name]
Thiourea, N-ethyl-N'-[(3-fluorophenyl)methyl]-N-(tetrahydro-1,1-dioxido-3-thienyl)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 504.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.4±3.0 kJ/mol
Flash Point: 258.9±32.9 °C
Index of Refraction: 1.608
Molar Refractivity: 85.3±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.06
ACD/LogD (pH 5.5): 1.40
ACD/BCF (pH 5.5): 6.84
ACD/KOC (pH 5.5): 137.90
ACD/LogD (pH 7.4): 1.40
ACD/BCF (pH 7.4): 6.84
ACD/KOC (pH 7.4): 137.90
Polar Surface Area: 90 Å2
Polarizability: 33.8±0.5 10-24cm3
Surface Tension: 58.0±5.0 dyne/cm
Molar Volume: 246.8±5.0 cm3

Click to predict properties on the Chemicalize site


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