ChemSpider 2D Image | 1-({1-[3-Fluoro-5-(trifluoromethyl)phenyl]cyclopropyl}methyl)-3-(1-oxidotetrahydro-3-thiophenyl)urea | C16H18F4N2O2S

1-({1-[3-Fluoro-5-(trifluoromethyl)phenyl]cyclopropyl}methyl)-3-(1-oxidotetrahydro-3-thiophenyl)urea

  • Molecular FormulaC16H18F4N2O2S
  • Average mass378.385 Da
  • Monoisotopic mass378.102509 Da
  • ChemSpider ID63563618

More details:

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

1-({1-[3-Fluor-5-(trifluormethyl)phenyl]cyclopropyl}methyl)-3-(1-oxidotetrahydro-3-thiophenyl)harnstoff [German] [ACD/IUPAC Name]
1-({1-[3-Fluoro-5-(trifluoromethyl)phenyl]cyclopropyl}methyl)-3-(1-oxidotetrahydro-3-thiophenyl)urea [ACD/IUPAC Name]
1-({1-[3-Fluoro-5-(trifluorométhyl)phényl]cyclopropyl}méthyl)-3-(1-oxydotétrahydro-3-thiophényl)urée [French] [ACD/IUPAC Name]
Urea, N-[[1-[3-fluoro-5-(trifluoromethyl)phenyl]cyclopropyl]methyl]-N'-(tetrahydro-1-oxido-3-thienyl)- [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: 561.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.4±3.0 kJ/mol
Flash Point: 293.1±30.1 °C
Index of Refraction: 1.574
Molar Refractivity: 85.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.46
ACD/LogD (pH 5.5): 1.60
ACD/BCF (pH 5.5): 9.64
ACD/KOC (pH 5.5): 176.19
ACD/LogD (pH 7.4): 1.60
ACD/BCF (pH 7.4): 9.64
ACD/KOC (pH 7.4): 176.18
Polar Surface Area: 77 Å2
Polarizability: 34.0±0.5 10-24cm3
Surface Tension: 53.9±5.0 dyne/cm
Molar Volume: 259.7±5.0 cm3

Click to predict properties on the Chemicalize site


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