Chemical Properties of Octaethylene glycol, monoallyl ether, acetate

InChI

InChI=1S/C21H40O10/c1-3-4-23-5-6-24-7-8-25-9-10-26-11-12-27-13-14-28-15-16-29-17-18-30-19-20-31-21(2)22/h3H,1,4-20H2,2H3

InChI Key

OMXAJRNUFKQGLL-UHFFFAOYSA-N

Formula

C21H40O10

SMILES

C=CCOCCOCCOCCOCCOCCOCCOCCOCCOC(C)=O

Molecular Weight¹

452.54

• 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	1.2404		Relay (1.0) Calculated Property
ΔfH°gas	-1686.66	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	62.74	kJ/mol	Joback Calculated Property
ΔvapH°	115.13	kJ/mol	Relay (1.0) Calculated Property
IE	9.29	eV	Relay (1.0) Calculated Property
log10WS	-0.80		Relay (1.0) Calculated Property
logPoct/wat	0.868		Crippen Calculated Property
McVol	356.850	ml/mol	McGowan Calculated Property
Pc	905.61	kPa	Joback Calculated Property
Inp	[2873.00; 2881.00]
Inp	2877.00		NIST
Inp	2881.00		NIST
Inp	2876.00		NIST
Inp	2878.00		NIST
Inp	2878.00		NIST
Inp	2879.00		NIST
Inp	2881.00		NIST
Inp	2878.00		NIST
Inp	Outlier 2873.00		NIST
Inp	2879.00		NIST
Inp	2875.00		NIST
Inp	2879.00		NIST
Inp	2877.00		NIST
Inp	2879.00		NIST
Inp	2875.00		NIST
Tboil	722.97	K	Relay (1.0) Calculated Property
Tc	854.68	K	Relay (1.0) Calculated Property
Tfus	218.56	K	Relay (1.0) Calculated Property
Vc	1.342	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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1191.29; 1263.86]	J/mol×K	[914.34; 1124.30]
Cp,gas	1191.29	J/mol×K	914.34	Joback Calculated Property
Cp,gas	1208.74	J/mol×K	949.33	Joback Calculated Property
Cp,gas	1224.13	J/mol×K	984.33	Joback Calculated Property
Cp,gas	1237.40	J/mol×K	1019.32	Joback Calculated Property
Cp,gas	1248.48	J/mol×K	1054.31	Joback Calculated Property
Cp,gas	1257.32	J/mol×K	1089.31	Joback Calculated Property
Cp,gas	1263.86	J/mol×K	1124.30	Joback Calculated Property
η	[0.0000056; 0.0000797]	Pa×s	[544.84; 914.34]
η	0.0000797	Pa×s	544.84	Joback Calculated Property
η	0.0000408	Pa×s	606.42	Joback Calculated Property
η	0.0000237	Pa×s	668.01	Joback Calculated Property
η	0.0000150	Pa×s	729.59	Joback Calculated Property
η	0.0000103	Pa×s	791.17	Joback Calculated Property
η	0.0000074	Pa×s	852.76	Joback Calculated Property
η	0.0000056	Pa×s	914.34	Joback Calculated Property

Similar Compounds

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

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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