Chemical Properties of 2-(2-(2-(2-(2-(2-Isopentoxy-ethoxy)-ethoxy)-ethoxy)-ethoxy)-ethoxy)-ethoxy)-ethyl acetate

InChI

InChI=1S/C21H42O9/c1-20(2)4-5-23-6-7-24-8-9-25-10-11-26-12-13-27-14-15-28-16-17-29-18-19-30-21(3)22/h20H,4-19H2,1-3H3

InChI Key

UZDYGKHEJAATER-UHFFFAOYSA-N

Formula

C21H42O9

SMILES

CC(=O)OCCOCCOCCOCCOCCOCCOCCOCCC(C)C

Molecular Weight¹

438.56

• 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	1.2124		Relay (1.0) Calculated Property
ΔfH°gas	-1669.33	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	59.31	kJ/mol	Joback Calculated Property
ΔvapH°	113.06	kJ/mol	Relay (1.0) Calculated Property
IE	9.35	eV	Relay (1.0) Calculated Property
log10WS	-1.66		Relay (1.0) Calculated Property
logPoct/wat	1.712		Crippen Calculated Property
McVol	355.280	ml/mol	McGowan Calculated Property
Pc	896.41	kPa	Joback Calculated Property
Inp	[2874.60; 2874.60]
Inp	2874.60		NIST
Inp	2874.60		NIST
Tboil	686.38	K	Relay (1.0) Calculated Property
Tc	836.45	K	Relay (1.0) Calculated Property
Tfus	216.78	K	Relay (1.0) Calculated Property
Vc	1.351	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	[1189.59; 1271.65]	J/mol×K	[894.80; 1098.12]
Cp,gas	1189.59	J/mol×K	894.80	Joback Calculated Property
Cp,gas	1208.10	J/mol×K	928.69	Joback Calculated Property
Cp,gas	1224.74	J/mol×K	962.57	Joback Calculated Property
Cp,gas	1239.46	J/mol×K	996.46	Joback Calculated Property
Cp,gas	1252.22	J/mol×K	1030.35	Joback Calculated Property
Cp,gas	1262.97	J/mol×K	1064.24	Joback Calculated Property
Cp,gas	1271.65	J/mol×K	1098.12	Joback Calculated Property
η	[0.0000065; 0.0001321]	Pa×s	[509.37; 894.80]
η	0.0001321	Pa×s	509.37	Joback Calculated Property
η	0.0000603	Pa×s	573.61	Joback Calculated Property
η	0.0000322	Pa×s	637.85	Joback Calculated Property
η	0.0000193	Pa×s	702.09	Joback Calculated Property
η	0.0000126	Pa×s	766.32	Joback Calculated Property
η	0.0000088	Pa×s	830.56	Joback Calculated Property
η	0.0000065	Pa×s	894.80	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-(2-(2-(2-(2-(2-Isopentoxy-ethoxy)-ethoxy)-ethoxy)-ethoxy)-ethoxy)-ethoxy)-ethyl 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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