Chemical Properties of Succinic acid, 3-methylbut-2-yl cis-hex-2-en-1-yl ester

InChI

InChI=1S/C15H26O4/c1-5-6-7-8-11-18-14(16)9-10-15(17)19-13(4)12(2)3/h7-8,12-13H,5-6,9-11H2,1-4H3/b8-7-

InChI Key

NAMRTCSSAUNDHN-FPLPWBNLSA-N

Formula

C15H26O4

SMILES

CCCC=CCOC(=O)CCC(=O)OC(C)C(C)C

Molecular Weight¹

270.36

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• 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 Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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	[341.73; 779.90]	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			2.25250e+01
Coefficient B			1.35108e+00
Coefficient C			-6.93200e-04
Coefficient D			9.95000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	341.73	J/mol×K	273.00	Calculated Property
Cp,gas	418.15	J/mol×K	353.78	Calculated Property
Cp,gas	486.91	J/mol×K	434.56	Calculated Property
Cp,gas	548.31	J/mol×K	515.33	Calculated Property
Cp,gas	602.67	J/mol×K	596.11	Calculated Property
Cp,gas	650.31	J/mol×K	676.89	Calculated Property
Cp,gas	691.53	J/mol×K	757.67	Calculated Property
Cp,gas	726.67	J/mol×K	838.44	Calculated Property
Cp,gas	756.02	J/mol×K	919.22	Calculated Property
Cp,gas	779.91	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0053376; 0.0001022]	Pa×s	[308.39; 590.37]	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			-1.35152e+01
Coefficient B			2.55416e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			308.39
Temperature range, max.			590.37
η	0.0053376	Pa×s	308.39	Calculated Property
η	0.0024867	Pa×s	339.72	Calculated Property
η	0.0013180	Pa×s	371.05	Calculated Property
η	0.0007711	Pa×s	402.38	Calculated Property
η	0.0004875	Pa×s	433.71	Calculated Property
η	0.0003279	Pa×s	465.05	Calculated Property
η	0.0002318	Pa×s	496.38	Calculated Property
η	0.0001708	Pa×s	527.71	Calculated Property
η	0.0001302	Pa×s	559.04	Calculated Property
η	0.0001022	Pa×s	590.37	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 3-methylbut-2-yl cis-hex-2-en-1-yl ester.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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