Chemical Properties of Glycerol - tripropylene glycol ether, triacetate

InChI

InChI=1S/C18H32O9/c1-12(7-23-14(3)9-25-15(4)19)22-8-13(2)24-10-18(27-17(6)21)11-26-16(5)20/h12-14,18H,7-11H2,1-6H3

InChI Key

CXMIOLAITPOURG-UHFFFAOYSA-N

Formula

C18H32O9

SMILES

CC(=O)OCC(C)OCC(C)OCC(C)OCC(COC(C)=O)OC(C)=O

Molecular Weight¹

392.44

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization 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_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.9460		Relay (1.0) Calculated Property
ΔfH°gas	-1760.15	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	44.95	kJ/mol	Joback Calculated Property
ΔvapH°	110.41	kJ/mol	Relay (1.0) Calculated Property
IE	9.03	eV	Relay (1.0) Calculated Property
log10WS	-0.81		Relay (1.0) Calculated Property
logPoct/wat	1.260		Crippen Calculated Property
McVol	304.410	ml/mol	McGowan Calculated Property
Pc	1149.10	kPa	Joback Calculated Property
Inp	[2172.00; 2180.00]
Inp	2177.00		NIST
Inp	2178.00		NIST
Inp	2179.00		NIST
Inp	2174.00		NIST
Inp	2174.00		NIST
Inp	2180.00		NIST
Inp	2180.00		NIST
Inp	Outlier 2172.00		NIST
Inp	2176.00		NIST
Inp	2180.00		NIST
Inp	2176.00		NIST
Inp	2180.00		NIST
Inp	2177.00		NIST
Inp	2180.00		NIST
Inp	2176.00		NIST
Tboil	626.36	K	Relay (1.0) Calculated Property
Tc	768.97	K	Relay (1.0) Calculated Property
Tfus	266.12	K	Relay (1.0) Calculated Property
Vc	1.160	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[481.30; 1029.95]	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			1.32525e+02
Coefficient B			1.38352e+00
Coefficient C			-3.51400e-04
Coefficient D			-1.34700e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	481.30	J/mol×K	273.00	Calculated Property
Cp,gas	572.04	J/mol×K	353.78	Calculated Property
Cp,gas	656.33	J/mol×K	434.56	Calculated Property
Cp,gas	733.74	J/mol×K	515.33	Calculated Property
Cp,gas	803.85	J/mol×K	596.11	Calculated Property
Cp,gas	866.24	J/mol×K	676.89	Calculated Property
Cp,gas	920.46	J/mol×K	757.67	Calculated Property
Cp,gas	966.10	J/mol×K	838.44	Calculated Property
Cp,gas	1002.74	J/mol×K	919.22	Calculated Property
Cp,gas	1029.94	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0007571; 0.0000204]	Pa×s	[426.30; 731.48]	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			-1.58466e+01
Coefficient B			3.69203e+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.			426.30
Temperature range, max.			731.48
η	0.0007571	Pa×s	426.30	Calculated Property
η	0.0004000	Pa×s	460.21	Calculated Property
η	0.0002306	Pa×s	494.12	Calculated Property
η	0.0001427	Pa×s	528.03	Calculated Property
η	0.0000936	Pa×s	561.94	Calculated Property
η	0.0000644	Pa×s	595.85	Calculated Property
η	0.0000461	Pa×s	629.75	Calculated Property
η	0.0000342	Pa×s	663.66	Calculated Property
η	0.0000261	Pa×s	697.57	Calculated Property
η	0.0000204	Pa×s	731.48	Calculated Property

Similar Compounds

Find more compounds similar to Glycerol - tripropylene glycol ether, triacetate.

Sources

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

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