Chemical Properties of 4-ethoxycarbonyl-«gamma»-butanolactone

InChI

InChI=1S/C7H10O4/c1-2-10-7(9)5-3-6(8)11-4-5/h5H,2-4H2,1H3

InChI Key

FESAUDRCHNHLNK-UHFFFAOYSA-N

Formula

C7H10O4

SMILES

CCOC(=O)C1COC(=O)C1

Molecular Weight¹

158.15

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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).
• 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 : 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
ΔfG°	-398.02	kJ/mol	Joback Calculated Property
ΔfH°gas	-641.83	kJ/mol	Joback Calculated Property
ΔfusH°	18.10	kJ/mol	Joback Calculated Property
ΔvapH°	49.35	kJ/mol	Joback Calculated Property
log10WS	-0.13		Crippen Calculated Property
logPoct/wat	0.113		Crippen Calculated Property
McVol	113.510	ml/mol	McGowan Calculated Property
Pc	3727.11	kPa	Joback Calculated Property
I	[2241.00; 2241.00]
I	2241.00		NIST
I	2241.00		NIST
Tboil	545.90	K	Joback Calculated Property
Tc	767.11	K	Joback Calculated Property
Tfus	346.50	K	Joback Calculated Property
Vc	0.420	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[275.48; 345.03]	J/mol×K	[545.90; 767.11]
Cp,gas	275.48	J/mol×K	545.90	Joback Calculated Property
Cp,gas	288.68	J/mol×K	582.77	Joback Calculated Property
Cp,gas	301.27	J/mol×K	619.64	Joback Calculated Property
Cp,gas	313.22	J/mol×K	656.50	Joback Calculated Property
Cp,gas	324.51	J/mol×K	693.37	Joback Calculated Property
Cp,gas	335.12	J/mol×K	730.24	Joback Calculated Property
Cp,gas	345.03	J/mol×K	767.11	Joback Calculated Property

Similar Compounds

Find more compounds similar to 4-ethoxycarbonyl-«gamma»-butanolactone.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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