Chemical Properties of Benzylamine, 4,4'-oxybis(n,n-diethyl- (CAS 17688-82-3)

InChI

InChI=1S/C22H32N2O/c1-5-23(6-2)17-19-9-13-21(14-10-19)25-22-15-11-20(12-16-22)18-24(7-3)8-4/h9-16H,5-8,17-18H2,1-4H3

InChI Key

KJZBIXNLDJXDTP-UHFFFAOYSA-N

Formula

C22H32N2O

SMILES

CCN(CC)Cc1ccc(Oc2ccc(CN(CC)CC)cc2)cc1

Molecular Weight¹

340.50

CAS

17688-82-3

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

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, 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, Log10 of Water solubility in mol/l 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	[409.19; 1005.76]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-5.22040e+01
Coefficient B			2.00168e+00
Coefficient C			-1.21552e-03
Coefficient D			2.71800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	409.19	J/mol×K	273.00	Calculated Property
Cp,gas	515.85	J/mol×K	353.78	Calculated Property
Cp,gas	610.40	J/mol×K	434.56	Calculated Property
Cp,gas	693.72	J/mol×K	515.33	Calculated Property
Cp,gas	766.66	J/mol×K	596.11	Calculated Property
Cp,gas	830.08	J/mol×K	676.89	Calculated Property
Cp,gas	884.84	J/mol×K	757.67	Calculated Property
Cp,gas	931.80	J/mol×K	838.44	Calculated Property
Cp,gas	971.82	J/mol×K	919.22	Calculated Property
Cp,gas	1005.76	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Benzylamine, 4,4'-oxybis(n,n-diethyl-.

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

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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