Chemical Properties of 1-Benzyl-3-(1-carbethoxy-3-methylbutyl) urea (CAS 93142-97-3)

InChI

InChI=1S/C16H24N2O3/c1-4-21-15(19)14(10-12(2)3)18-16(20)17-11-13-8-6-5-7-9-13/h5-9,12,14H,4,10-11H2,1-3H3,(H2,17,18,20)

InChI Key

WMHZYIFTZXFFRZ-UHFFFAOYSA-N

Formula

C16H24N2O3

SMILES

CCOC(=O)C(CC(C)C)NC(=O)NCc1ccccc1

Molecular Weight¹

292.37

CAS

93142-97-3

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[729.83; 801.43]	J/mol×K	[803.91; 1012.21]
Cp,gas	729.83	J/mol×K	803.91	Joback Calculated Property
Cp,gas	744.46	J/mol×K	838.63	Joback Calculated Property
Cp,gas	757.95	J/mol×K	873.34	Joback Calculated Property
Cp,gas	770.36	J/mol×K	908.06	Joback Calculated Property
Cp,gas	781.72	J/mol×K	942.77	Joback Calculated Property
Cp,gas	792.06	J/mol×K	977.49	Joback Calculated Property
Cp,gas	801.43	J/mol×K	1012.21	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1-Benzyl-3-(1-carbethoxy-3-methylbutyl) urea.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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