Chemical Properties of Urea, N,N-diphenyl-N'-octyl-

InChI

InChI=1S/C21H28N2O/c1-2-3-4-5-6-13-18-22-21(24)23(19-14-9-7-10-15-19)20-16-11-8-12-17-20/h7-12,14-17H,2-6,13,18H2,1H3,(H,22,24)

InChI Key

KUCLHJRQRGSKFN-UHFFFAOYSA-N

Formula

C21H28N2O

SMILES

CCCCCCCCNC(=O)N(c1ccccc1)c1ccccc1

Molecular Weight¹

324.47

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• 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

Property	Value	Unit	Source
ΔfusH°	47.95	kJ/mol	Joback Calculated Property
IE	8.00	eV	Relay (1.0) Calculated Property
log10WS	-5.73		Relay (1.0) Calculated Property
logPoct/wat	5.895		Crippen Calculated Property
McVol	280.760	ml/mol	McGowan Calculated Property
Pc	1602.56	kPa	Joback Calculated Property
Inp	[2689.00; 2689.00]
Inp	2689.00		NIST
Inp	2689.00		NIST
Tboil	657.42	K	Relay (1.0) Calculated Property
Tfus	358.67	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor 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	[868.11; 951.64]	J/mol×K	[849.92; 1066.54]
Cp,gas	868.11	J/mol×K	849.92	Joback Calculated Property
Cp,gas	884.65	J/mol×K	886.02	Joback Calculated Property
Cp,gas	900.03	J/mol×K	922.13	Joback Calculated Property
Cp,gas	914.32	J/mol×K	958.23	Joback Calculated Property
Cp,gas	927.62	J/mol×K	994.33	Joback Calculated Property
Cp,gas	940.03	J/mol×K	1030.43	Joback Calculated Property
Cp,gas	951.64	J/mol×K	1066.54	Joback Calculated Property

Similar Compounds

Find more compounds similar to Urea, N,N-diphenyl-N'-octyl-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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