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

InChI

InChI=1S/C17H34O7/c1-16(2)4-5-19-6-7-20-8-9-21-10-11-22-12-13-23-14-15-24-17(3)18/h16H,4-15H2,1-3H3

InChI Key

KZDQLVJGYFYXHT-UHFFFAOYSA-N

Formula

C17H34O7

SMILES

CC(=O)OCCOCCOCCOCCOCCOCCC(C)C

Molecular Weight¹

350.45

• 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	1.0066		Relay (1.0) Calculated Property
ΔfH°gas	-1343.07	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	46.57	kJ/mol	Joback Calculated Property
ΔvapH°	98.36	kJ/mol	Relay (1.0) Calculated Property
IE	9.33	eV	Relay (1.0) Calculated Property
log10WS	-1.64		Relay (1.0) Calculated Property
logPoct/wat	1.679		Crippen Calculated Property
McVol	287.180	ml/mol	McGowan Calculated Property
Pc	1171.22	kPa	Joback Calculated Property
Inp	[2310.10; 2310.10]
Inp	2310.10		NIST
Inp	2310.10		NIST
Tboil	633.47	K	Relay (1.0) Calculated Property
Tc	787.92	K	Relay (1.0) Calculated Property
Tfus	221.66	K	Relay (1.0) Calculated Property
Vc	1.092	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	[459.16; 997.52]	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			1.38662e+02
Coefficient B			1.25396e+00
Coefficient C			-2.54600e-04
Coefficient D			-1.40500e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	459.16	J/mol×K	273.00	Calculated Property
Cp,gas	544.20	J/mol×K	353.78	Calculated Property
Cp,gas	623.97	J/mol×K	434.56	Calculated Property
Cp,gas	698.03	J/mol×K	515.33	Calculated Property
Cp,gas	765.93	J/mol×K	596.11	Calculated Property
Cp,gas	827.23	J/mol×K	676.89	Calculated Property
Cp,gas	881.48	J/mol×K	757.67	Calculated Property
Cp,gas	928.24	J/mol×K	838.44	Calculated Property
Cp,gas	967.07	J/mol×K	919.22	Calculated Property
Cp,gas	997.52	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0005146; 0.0000418]	Pa×s	[419.83; 653.35]	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			-1.45968e+01
Coefficient B			2.94915e+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.			419.83
Temperature range, max.			653.35
η	0.0005146	Pa×s	419.83	Calculated Property
η	0.0003419	Pa×s	445.78	Calculated Property
η	0.0002376	Pa×s	471.72	Calculated Property
η	0.0001715	Pa×s	497.67	Calculated Property
η	0.0001279	Pa×s	523.62	Calculated Property
η	0.0000980	Pa×s	549.56	Calculated Property
η	0.0000769	Pa×s	575.51	Calculated Property
η	0.0000617	Pa×s	601.46	Calculated Property
η	0.0000504	Pa×s	627.40	Calculated Property
η	0.0000418	Pa×s	653.35	Calculated Property

Similar Compounds

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

Sources

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

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