Chemical Properties of 2-(2-Isopentoxyethoxy)ethyl acetate

InChI

InChI=1S/C11H22O4/c1-10(2)4-5-13-6-7-14-8-9-15-11(3)12/h10H,4-9H2,1-3H3

InChI Key

BAHUAGUWSSWQFO-UHFFFAOYSA-N

Formula

C11H22O4

SMILES

CC(=O)OCCOCCOCCC(C)C

Molecular Weight¹

218.29

• 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	0.6894		Relay (1.0) Calculated Property
ΔfH°gas	-851.17	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	27.47	kJ/mol	Joback Calculated Property
ΔvapH°	73.73	kJ/mol	Relay (1.0) Calculated Property
IE	9.45	eV	Relay (1.0) Calculated Property
log10WS	-1.50		Relay (1.0) Calculated Property
logPoct/wat	1.629		Crippen Calculated Property
McVol	185.030	ml/mol	McGowan Calculated Property
Pc	1898.60	kPa	Joback Calculated Property
Inp	[1463.50; 1463.50]
Inp	1463.50		NIST
Inp	1463.50		NIST
Tboil	528.84	K	Relay (1.0) Calculated Property
Tc	693.92	K	Relay (1.0) Calculated Property
Tfus	216.61	K	Relay (1.0) Calculated Property
Vc	0.697	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	[463.27; 545.35]	J/mol×K	[553.90; 724.52]
Cp,gas	463.27	J/mol×K	553.90	Joback Calculated Property
Cp,gas	478.36	J/mol×K	582.34	Joback Calculated Property
Cp,gas	492.90	J/mol×K	610.77	Joback Calculated Property
Cp,gas	506.88	J/mol×K	639.21	Joback Calculated Property
Cp,gas	520.28	J/mol×K	667.65	Joback Calculated Property
Cp,gas	533.11	J/mol×K	696.09	Joback Calculated Property
Cp,gas	545.35	J/mol×K	724.52	Joback Calculated Property
η	[0.0001145; 0.0035153]	Pa×s	[285.52; 553.90]
η	0.0035153	Pa×s	285.52	Joback Calculated Property
η	0.0013497	Pa×s	330.25	Joback Calculated Property
η	0.0006512	Pa×s	374.98	Joback Calculated Property
η	0.0003670	Pa×s	419.71	Joback Calculated Property
η	0.0002309	Pa×s	464.44	Joback Calculated Property
η	0.0001577	Pa×s	509.17	Joback Calculated Property
η	0.0001145	Pa×s	553.90	Joback Calculated Property

Similar Compounds

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

Sources

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

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