Chemical Properties of Tetrapropylene glycol, monoallyl ether, acetate

InChI

InChI=1S/C17H32O6/c1-7-8-19-9-13(2)20-10-14(3)21-11-15(4)22-12-16(5)23-17(6)18/h7,13-16H,1,8-12H2,2-6H3

InChI Key

WZEGDFKELOHDFG-UHFFFAOYSA-N

Formula

C17H32O6

SMILES

C=CCOCC(C)OCC(C)OCC(C)OCC(C)OC(C)=O

Molecular Weight¹

332.44

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• 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_c : Critical Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	33.53	kJ/mol	Joback Calculated Property
IE	9.09	eV	Relay (1.0) Calculated Property
logPoct/wat	2.356		Crippen Calculated Property
McVol	277.010	ml/mol	McGowan Calculated Property
Pc	1240.71	kPa	Joback Calculated Property
Inp	[1861.00; 1869.00]
Inp	1862.00		NIST
Inp	1863.00		NIST
Inp	1863.00		NIST
Inp	1866.00		NIST
Inp	1861.00		NIST
Inp	1866.00		NIST
Inp	1866.00		NIST
Inp	1861.00		NIST
Inp	1866.00		NIST
Inp	1868.00		NIST
Inp	1868.00		NIST
Inp	1869.00		NIST
Inp	1862.00		NIST
Inp	1866.00		NIST
Inp	1868.00		NIST
Tboil	606.61	K	Relay (1.0) Calculated Property
Tc	745.74	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, 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	[433.00; 952.12]	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			1.05125e+02
Coefficient B			1.31490e+00
Coefficient C			-3.98100e-04
Coefficient D			-6.98000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	433.00	J/mol×K	273.00	Calculated Property
Cp,gas	517.39	J/mol×K	353.78	Calculated Property
Cp,gas	595.62	J/mol×K	434.56	Calculated Property
Cp,gas	667.46	J/mol×K	515.33	Calculated Property
Cp,gas	732.70	J/mol×K	596.11	Calculated Property
Cp,gas	791.12	J/mol×K	676.89	Calculated Property
Cp,gas	842.49	J/mol×K	757.67	Calculated Property
Cp,gas	886.59	J/mol×K	838.44	Calculated Property
Cp,gas	923.21	J/mol×K	919.22	Calculated Property
Cp,gas	952.12	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0017769; 0.0000449]	Pa×s	[350.84; 636.64]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.45285e+01
Coefficient B			2.87536e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			350.84
Temperature range, max.			636.64
η	0.0017769	Pa×s	350.84	Calculated Property
η	0.0009000	Pa×s	382.60	Calculated Property
η	0.0005059	Pa×s	414.35	Calculated Property
η	0.0003087	Pa×s	446.11	Calculated Property
η	0.0002012	Pa×s	477.86	Calculated Property
η	0.0001383	Pa×s	509.62	Calculated Property
η	0.0000993	Pa×s	541.37	Calculated Property
η	0.0000740	Pa×s	573.13	Calculated Property
η	0.0000569	Pa×s	604.88	Calculated Property
η	0.0000449	Pa×s	636.64	Calculated Property

Similar Compounds

Find more compounds similar to Tetrapropylene glycol, monoallyl ether, acetate.

Sources

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

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