Chemical Properties of Succinaldehydic acid, methyl ester

InChI

InChI=1S/C5H8O3/c1-8-5(7)3-2-4-6/h4H,2-3H2,1H3

InChI Key

DLZVZNAPRCRXEG-UHFFFAOYSA-N

Formula

C5H8O3

SMILES

COC(=O)CCC=O

Molecular Weight¹

116.12

Other Names

• methyl 4-oxobutyrate

• 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).
• 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

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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[132.80; 276.17]	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			3.51520e+01
Coefficient B			3.98520e-01
Coefficient C			-1.46600e-04
Coefficient D			-1.09000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	132.80	J/mol×K	273.00	Calculated Property
Cp,gas	157.31	J/mol×K	353.78	Calculated Property
Cp,gas	179.75	J/mol×K	434.56	Calculated Property
Cp,gas	200.10	J/mol×K	515.33	Calculated Property
Cp,gas	218.31	J/mol×K	596.11	Calculated Property
Cp,gas	234.36	J/mol×K	676.89	Calculated Property
Cp,gas	248.20	J/mol×K	757.67	Calculated Property
Cp,gas	259.81	J/mol×K	838.44	Calculated Property
Cp,gas	269.14	J/mol×K	919.22	Calculated Property
Cp,gas	276.17	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0048631; 0.0003313]	Pa×s	[230.44; 422.05]	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			-1.12434e+01
Coefficient B			1.36359e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			230.44
Temperature range, max.			422.05
η	0.0048631	Pa×s	230.44	Calculated Property
η	0.0029483	Pa×s	251.73	Calculated Property
η	0.0019325	Pa×s	273.02	Calculated Property
η	0.0013465	Pa×s	294.31	Calculated Property
η	0.0009851	Pa×s	315.60	Calculated Property
η	0.0007497	Pa×s	336.89	Calculated Property
η	0.0005894	Pa×s	358.18	Calculated Property
η	0.0004760	Pa×s	379.47	Calculated Property
η	0.0003933	Pa×s	400.76	Calculated Property
η	0.0003313	Pa×s	422.05	Calculated Property

Similar Compounds

Find more compounds similar to Succinaldehydic acid, methyl ester.

Sources

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

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