Chemical Properties of Fumaric acid, 3-methylbut-2-yl pentyl ester

InChI

InChI=1S/C14H24O4/c1-5-6-7-10-17-13(15)8-9-14(16)18-12(4)11(2)3/h8-9,11-12H,5-7,10H2,1-4H3/b9-8+

InChI Key

YGSZSBLSSQIVRK-CMDGGOBGSA-N

Formula

C14H24O4

SMILES

CCCCCOC(=O)C=CC(=O)OC(C)C(C)C

Molecular Weight¹

256.34

• 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).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[601.07; 683.37]	J/mol×K	[675.58; 862.18]
Cp,gas	601.07	J/mol×K	675.58	Joback Calculated Property
Cp,gas	616.74	J/mol×K	706.68	Joback Calculated Property
Cp,gas	631.60	J/mol×K	737.78	Joback Calculated Property
Cp,gas	645.68	J/mol×K	768.88	Joback Calculated Property
Cp,gas	658.99	J/mol×K	799.98	Joback Calculated Property
Cp,gas	671.55	J/mol×K	831.08	Joback Calculated Property
Cp,gas	683.37	J/mol×K	862.18	Joback Calculated Property
η	[0.0000886; 0.0021664]	Pa×s	[356.78; 675.58]
η	0.0021664	Pa×s	356.78	Joback Calculated Property
η	0.0009003	Pa×s	409.91	Joback Calculated Property
η	0.0004576	Pa×s	463.05	Joback Calculated Property
η	0.0002674	Pa×s	516.18	Joback Calculated Property
η	0.0001727	Pa×s	569.31	Joback Calculated Property
η	0.0001202	Pa×s	622.45	Joback Calculated Property
η	0.0000886	Pa×s	675.58	Joback Calculated Property

Similar Compounds

Find more compounds similar to Fumaric acid, 3-methylbut-2-yl pentyl 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.