Chemical Properties of DIETHYL 3-HYDROXYGLUTARATE

InChI

InChI=1S/C9H16O5/c1-3-13-8(11)5-7(10)6-9(12)14-4-2/h7,10H,3-6H2,1-2H3

InChI Key

OLLQYIBTJXUEEX-UHFFFAOYSA-N

Formula

C9H16O5

SMILES

CCOC(=O)CC(O)CC(=O)OCC

Molecular Weight¹

204.22

Other Names

• Diethyl- «beta»-hydroxyglutarate
• Pentanedioic acid, 3-hydroxy-, diethyl ester

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (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

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[241.27; 519.07]	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			4.91340e+01
Coefficient B			7.89140e-01
Coefficient C			-3.10200e-04
Coefficient D			-9.00000e-09
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	241.27	J/mol×K	273.00	Calculated Property
Cp,gas	289.09	J/mol×K	353.78	Calculated Property
Cp,gas	332.74	J/mol×K	434.56	Calculated Property
Cp,gas	372.19	J/mol×K	515.33	Calculated Property
Cp,gas	407.41	J/mol×K	596.11	Calculated Property
Cp,gas	438.38	J/mol×K	676.89	Calculated Property
Cp,gas	465.05	J/mol×K	757.67	Calculated Property
Cp,gas	487.41	J/mol×K	838.44	Calculated Property
Cp,gas	505.43	J/mol×K	919.22	Calculated Property
Cp,gas	519.07	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0118823; 0.0001000]	Pa×s	[321.67; 550.80]	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			-1.59188e+01
Coefficient B			3.69473e+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.			321.67
Temperature range, max.			550.80
η	0.0118823	Pa×s	321.67	Calculated Property
η	0.0051174	Pa×s	347.13	Calculated Property
η	0.0024729	Pa×s	372.59	Calculated Property
η	0.0013115	Pa×s	398.05	Calculated Property
η	0.0007506	Pa×s	423.50	Calculated Property
η	0.0004577	Pa×s	448.96	Calculated Property
η	0.0002943	Pa×s	474.42	Calculated Property
η	0.0001979	Pa×s	499.88	Calculated Property
η	0.0001383	Pa×s	525.34	Calculated Property
η	0.0001000	Pa×s	550.80	Calculated Property

Similar Compounds

Find more compounds similar to DIETHYL 3-HYDROXYGLUTARATE.

Sources

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

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