Chemical Properties of Decaethylene glycol, monoallyl ether, acetate

InChI

InChI=1S/C25H48O12/c1-3-4-27-5-6-28-7-8-29-9-10-30-11-12-31-13-14-32-15-16-33-17-18-34-19-20-35-21-22-36-23-24-37-25(2)26/h3H,1,4-24H2,2H3

InChI Key

ZAJPTYZVTJIYMH-UHFFFAOYSA-N

Formula

C25H48O12

SMILES

C=CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC(C)=O

Molecular Weight¹

540.64

• 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	1.4429		Relay (1.0) Calculated Property
ΔfH°gas	-2011.93	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	75.48	kJ/mol	Joback Calculated Property
ΔvapH°	128.93	kJ/mol	Relay (1.0) Calculated Property
IE	9.35	eV	Relay (1.0) Calculated Property
log10WS	-0.82		Relay (1.0) Calculated Property
logPoct/wat	0.902		Crippen Calculated Property
McVol	424.950	ml/mol	McGowan Calculated Property
Pc	714.54	kPa	Joback Calculated Property
Inp	[3296.00; 3304.00]
Inp	3298.00		NIST
Inp	3300.00		NIST
Inp	3296.00		NIST
Inp	3300.00		NIST
Inp	3300.00		NIST
Inp	3300.00		NIST
Inp	3296.00		NIST
Inp	Outlier 3304.00		NIST
Inp	3296.00		NIST
Inp	3298.00		NIST
Inp	3300.00		NIST
Inp	3297.00		NIST
Inp	3298.00		NIST
Inp	3300.00		NIST
Tboil	773.80	K	Relay (1.0) Calculated Property
Tc	898.95	K	Relay (1.0) Calculated Property
Tfus	207.44	K	Relay (1.0) Calculated Property
Vc	1.597	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	[696.40; 1473.70]	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			2.57581e+02
Coefficient B			1.67202e+00
Coefficient C			-1.54500e-04
Coefficient D			-3.01400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	696.40	J/mol×K	273.00	Calculated Property
Cp,gas	816.42	J/mol×K	353.78	Calculated Property
Cp,gas	930.26	J/mol×K	434.56	Calculated Property
Cp,gas	1036.95	J/mol×K	515.33	Calculated Property
Cp,gas	1135.54	J/mol×K	596.11	Calculated Property
Cp,gas	1225.09	J/mol×K	676.89	Calculated Property
Cp,gas	1304.63	J/mol×K	757.67	Calculated Property
Cp,gas	1373.21	J/mol×K	838.44	Calculated Property
Cp,gas	1429.89	J/mol×K	919.22	Calculated Property
Cp,gas	1473.70	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0000209; 0.0000025]	Pa×s	[634.38; 932.99]	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			-1.74142e+01
Coefficient B			4.20990e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			634.38
Temperature range, max.			932.99
η	0.0000209	Pa×s	634.38	Calculated Property
η	0.0000150	Pa×s	667.56	Calculated Property
η	0.0000111	Pa×s	700.74	Calculated Property
η	0.0000085	Pa×s	733.92	Calculated Property
η	0.0000066	Pa×s	767.10	Calculated Property
η	0.0000053	Pa×s	800.28	Calculated Property
η	0.0000043	Pa×s	833.46	Calculated Property
η	0.0000035	Pa×s	866.63	Calculated Property
η	0.0000029	Pa×s	899.81	Calculated Property
η	0.0000025	Pa×s	932.99	Calculated Property

Similar Compounds

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

Sources

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

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