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

InChI

InChI=1S/C25H50O11/c1-24(2)4-5-27-6-7-28-8-9-29-10-11-30-12-13-31-14-15-32-16-17-33-18-19-34-20-21-35-22-23-36-25(3)26/h24H,4-23H2,1-3H3

InChI Key

LETSAULJOPLZGD-UHFFFAOYSA-N

Formula

C25H50O11

SMILES

CC(=O)OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(C)C

Molecular Weight¹

526.66

• 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	1.4153		Relay (1.0) Calculated Property
ΔfH°gas	-1992.58	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	72.04	kJ/mol	Joback Calculated Property
ΔvapH°	127.05	kJ/mol	Relay (1.0) Calculated Property
IE	9.39	eV	Relay (1.0) Calculated Property
log10WS	-1.65		Relay (1.0) Calculated Property
logPoct/wat	1.745		Crippen Calculated Property
McVol	423.380	ml/mol	McGowan Calculated Property
Pc	708.09	kPa	Joback Calculated Property
Inp	[3446.40; 3446.40]
Inp	3446.40		NIST
Inp	3446.40		NIST
Tboil	737.18	K	Relay (1.0) Calculated Property
Tc	880.53	K	Relay (1.0) Calculated Property
Tfus	208.36	K	Relay (1.0) Calculated Property
Vc	1.608	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	[690.49; 1484.25]	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			2.33390e+02
Coefficient B			1.76116e+00
Coefficient C			-2.45800e-04
Coefficient D			-2.64500e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	690.49	J/mol×K	273.00	Calculated Property
Cp,gas	813.97	J/mol×K	353.78	Calculated Property
Cp,gas	930.59	J/mol×K	434.56	Calculated Property
Cp,gas	1039.50	J/mol×K	515.33	Calculated Property
Cp,gas	1139.86	J/mol×K	596.11	Calculated Property
Cp,gas	1230.85	J/mol×K	676.89	Calculated Property
Cp,gas	1311.62	J/mol×K	757.67	Calculated Property
Cp,gas	1381.33	J/mol×K	838.44	Calculated Property
Cp,gas	1439.15	J/mol×K	919.22	Calculated Property
Cp,gas	1484.25	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0000327; 0.0000030]	Pa×s	[598.91; 909.95]	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			-1.73254e+01
Coefficient B			4.19079e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			598.91
Temperature range, max.			909.95
η	0.0000327	Pa×s	598.91	Calculated Property
η	0.0000223	Pa×s	633.47	Calculated Property
η	0.0000159	Pa×s	668.03	Calculated Property
η	0.0000116	Pa×s	702.59	Calculated Property
η	0.0000088	Pa×s	737.15	Calculated Property
η	0.0000068	Pa×s	771.71	Calculated Property
η	0.0000054	Pa×s	806.27	Calculated Property
η	0.0000044	Pa×s	840.83	Calculated Property
η	0.0000036	Pa×s	875.39	Calculated Property
η	0.0000030	Pa×s	909.95	Calculated Property

Similar Compounds

Find more compounds similar to 2-(2-(2-(2-(2-(2-(2-(2-Isopentoxy-ethoxy)-ethoxy)-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.
These property values are available through the Cheméo API. A free account gives you an access key.