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

• ω : Acentric Factor.
• 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).
• 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 : 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	0.4832		Relay (1.0) Calculated Property
ΔfG°	-398.02	kJ/mol	Joback Calculated Property
ΔfH°gas	-714.40	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	18.10	kJ/mol	Joback Calculated Property
ΔvapH°	65.22	kJ/mol	Relay (1.0) Calculated Property
IE	10.19	eV	Relay (1.0) Calculated Property
log10WS	-1.07		Relay (1.0) 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	545.10	K	Relay (1.0) Calculated Property
Tc	715.54	K	Relay (1.0) Calculated Property
Tfus	297.34	K	Relay (1.0) Calculated Property
Vc	0.426	m3/kmol	Relay (1.0) 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

• 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.