Chemical Properties of Succinic acid, butyl 2,4-dimethylpent-3-yl ester

InChI

InChI=1S/C15H28O4/c1-6-7-10-18-13(16)8-9-14(17)19-15(11(2)3)12(4)5/h11-12,15H,6-10H2,1-5H3

InChI Key

ALYSQJHGWPIINB-UHFFFAOYSA-N

Formula

C15H28O4

SMILES

CCCCOC(=O)CCC(=O)OC(C(C)C)C(C)C

Molecular Weight¹

272.38

• 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).
• I_np : Non-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

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	[355.42; 811.02]	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			3.50250e+01
Coefficient B			1.33700e+00
Coefficient C			-6.12600e-04
Coefficient D			5.16000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	355.42	J/mol×K	273.00	Calculated Property
Cp,gas	433.64	J/mol×K	353.78	Calculated Property
Cp,gas	504.58	J/mol×K	434.56	Calculated Property
Cp,gas	568.40	J/mol×K	515.33	Calculated Property
Cp,gas	625.27	J/mol×K	596.11	Calculated Property
Cp,gas	675.35	J/mol×K	676.89	Calculated Property
Cp,gas	718.80	J/mol×K	757.67	Calculated Property
Cp,gas	755.79	J/mol×K	838.44	Calculated Property
Cp,gas	786.48	J/mol×K	919.22	Calculated Property
Cp,gas	811.03	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0082962; 0.0001134]	Pa×s	[298.47; 585.05]	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			-1.35558e+01
Coefficient B			2.61574e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			298.47
Temperature range, max.			585.05
η	0.0082962	Pa×s	298.47	Calculated Property
η	0.0035643	Pa×s	330.31	Calculated Property
η	0.0017766	Pa×s	362.15	Calculated Property
η	0.0009910	Pa×s	394.00	Calculated Property
η	0.0006032	Pa×s	425.84	Calculated Property
η	0.0003934	Pa×s	457.68	Calculated Property
η	0.0002713	Pa×s	489.52	Calculated Property
η	0.0001957	Pa×s	521.37	Calculated Property
η	0.0001466	Pa×s	553.21	Calculated Property
η	0.0001134	Pa×s	585.05	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, butyl 2,4-dimethylpent-3-yl ester.

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.
These property values are available through the Cheméo API. A free account gives you an access key.