Chemical Properties of Cycluron (CAS 2163-69-1)

Cycluron

InChI
InChI=1S/C11H22N2O/c1-13(2)11(14)12-10-8-6-4-3-5-7-9-10/h10H,3-9H2,1-2H3,(H,12,14)
InChI Key
DQZCVNGCTZLGAQ-UHFFFAOYSA-N
Formula
C11H22N2O
SMILES
CN(C)C(=O)NC1CCCCCCC1
Molecular Weight1
198.31
CAS
2163-69-1
Other Names
  • 1,1-Dimethyl-3-cyclooctylurea
  • 3-Cyclooctyl-1,1-dimethylharnstoff
  • 3-Cyclooctyl-1,1-dimethylurea
  • Cyclouron
  • HS 61
  • N'-Cyclooctyl-N,N-dimethylurea
  • N-Cyclooctyl-N',N'-dimethylurea
  • OMU
  • Urea, 3-cyclooctyl-1,1-dimethyl-
  • Urea, N'-cyclooctyl-N,N-dimethyl-
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Physical Properties

Property Value Unit Source
ΔfusH° 21.60 kJ/mol Joback Calculated Property
log10WS [-2.36; -2.22]   Show Hide
log10WS -2.36 Aq. Solubility Prediction
log10WS -2.22 Estimated Solubility
logPoct/wat 2.371 Crippen Calculated Property
McVol 176.520 ml/mol McGowan Calculated Property
Tfus 369.62 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [223.55; 639.40] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-8.75000e+01
Coefficient B1.32384e+00
Coefficient C-7.05300e-04
Coefficient D1.08360e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 223.55 J/mol×K 273.00 Calculated Property
Cp,gas 297.37 J/mol×K 353.78 Calculated Property
Cp,gas 363.49 J/mol×K 434.56 Calculated Property
Cp,gas 422.24 J/mol×K 515.33 Calculated Property
Cp,gas 473.98 J/mol×K 596.11 Calculated Property
Cp,gas 519.05 J/mol×K 676.89 Calculated Property
Cp,gas 557.78 J/mol×K 757.67 Calculated Property
Cp,gas 590.52 J/mol×K 838.44 Calculated Property
Cp,gas 617.61 J/mol×K 919.22 Calculated Property
Cp,gas 639.40 J/mol×K 1000.00 Calculated Property

Similar Compounds

1,3-Dicyclohexylurea. Noruron. Urea, 1-(2-chloroethyl)-3-cycloheptyl-. Urea, 1,1'-(1,4-cyclohexylene)bis[3-(2-chloroethyl)]-, trans. 1-1'-(1,4-Cyclohexylene)bis[3-(2-chloroethyl) urea], trans-. Urea, 1-cyclohexyl-3-hydroxyethyl-. Urea, 1-acetyl-1,3-dicyclohexyl-. Urea, 1-(2-fluoroethyl)-3-(2-norbornanyl)-. Urea, 1-(2-chloroethyl)-3-(3,3,5-trimethylcyclohexyl)-. N-(2-chlorocyclohexyl)-n'-methylurea. Urea, 1-(2-chlorocyclohexyl)-3-methyl-, trans-. Urea, p-menth-3-yl-. N,n'-bis-(2-chlorocyclohexyl)urea. Urea, 1,3-bis(2-chlorocyclohexyl)-. 1,1'-(1,2-Cyclohexylene)bis[3-(2-chloroethyl)urea], trans.

Find more compounds similar to Cycluron.

Sources

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