Chemical Properties of Butanedioic acid, 2-ethyl-2-hydroxy, dimethyl ester

InChI

InChI=1S/C8H14O5/c1-4-8(11,7(10)13-3)5-6(9)12-2/h11H,4-5H2,1-3H3

InChI Key

AHVQMKGBZAIWQZ-UHFFFAOYSA-N

Formula

C8H14O5

SMILES

CCC(O)(CC(=O)OC)C(=O)OC

Molecular Weight¹

190.19

Other Names

• Butanedioic acid, 2-hydroxy-2-ethyl, dimethyl ester

• 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_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[218.91; 468.41]	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			2.72520e+01
Coefficient B			8.14060e-01
Coefficient C			-4.24400e-04
Coefficient D			5.15000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	218.91	J/mol×K	273.00	Calculated Property
Cp,gas	264.41	J/mol×K	353.78	Calculated Property
Cp,gas	305.09	J/mol×K	434.56	Calculated Property
Cp,gas	341.11	J/mol×K	515.33	Calculated Property
Cp,gas	372.62	J/mol×K	596.11	Calculated Property
Cp,gas	399.80	J/mol×K	676.89	Calculated Property
Cp,gas	422.81	J/mol×K	757.67	Calculated Property
Cp,gas	441.80	J/mol×K	838.44	Calculated Property
Cp,gas	456.95	J/mol×K	919.22	Calculated Property
Cp,gas	468.41	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0101611; 0.0001102]	Pa×s	[327.82; 537.36]	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			-1.61910e+01
Coefficient B			3.80329e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			327.82
Temperature range, max.			537.36
η	0.0101611	Pa×s	327.82	Calculated Property
η	0.0047078	Pa×s	351.10	Calculated Property
η	0.0024002	Pa×s	374.39	Calculated Property
η	0.0013242	Pa×s	397.67	Calculated Property
η	0.0007802	Pa×s	420.95	Calculated Property
η	0.0004859	Pa×s	444.23	Calculated Property
η	0.0003172	Pa×s	467.52	Calculated Property
η	0.0002157	Pa×s	490.80	Calculated Property
η	0.0001518	Pa×s	514.08	Calculated Property
η	0.0001102	Pa×s	537.36	Calculated Property

Similar Compounds

Find more compounds similar to Butanedioic acid, 2-ethyl-2-hydroxy, dimethyl ester.

Sources

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

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