Chemical Properties of Succinic acid, cyclohexylmethyl hept-1,6-dien-4-yl ester

InChI

InChI=1S/C18H28O4/c1-3-8-16(9-4-2)22-18(20)13-12-17(19)21-14-15-10-6-5-7-11-15/h3-4,15-16H,1-2,5-14H2

InChI Key

HRUVINYFRULCNB-UHFFFAOYSA-N

Formula

C18H28O4

SMILES

C=CCC(CC=C)OC(=O)CCC(=O)OCC1CCCCC1

Molecular Weight¹

308.42

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

Physical Properties

Property	Value	Unit	Source
ΔfusH°	36.87	kJ/mol	Joback Calculated Property
logPoct/wat	3.954		Crippen Calculated Property
McVol	259.900	ml/mol	McGowan Calculated Property
Inp	[2132.00; 2132.00]
Inp	2132.00		NIST
Inp	2132.00		NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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	[361.95; 892.77]	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			-3.59250e+01
Coefficient B			1.69220e+00
Coefficient C			-8.96200e-04
Coefficient D			1.32700e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	361.95	J/mol×K	273.00	Calculated Property
Cp,gas	456.45	J/mol×K	353.78	Calculated Property
Cp,gas	541.08	J/mol×K	434.56	Calculated Property
Cp,gas	616.28	J/mol×K	515.33	Calculated Property
Cp,gas	682.46	J/mol×K	596.11	Calculated Property
Cp,gas	740.04	J/mol×K	676.89	Calculated Property
Cp,gas	789.44	J/mol×K	757.67	Calculated Property
Cp,gas	831.09	J/mol×K	838.44	Calculated Property
Cp,gas	865.39	J/mol×K	919.22	Calculated Property
Cp,gas	892.77	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0029704; 0.0000990]	Pa×s	[366.14; 656.30]	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			-1.35115e+01
Coefficient B			2.81653e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			366.14
Temperature range, max.			656.30
η	0.0029704	Pa×s	366.14	Calculated Property
η	0.0015939	Pa×s	398.38	Calculated Property
η	0.0009388	Pa×s	430.62	Calculated Property
η	0.0005953	Pa×s	462.86	Calculated Property
η	0.0004005	Pa×s	495.10	Calculated Property
η	0.0002829	Pa×s	527.34	Calculated Property
η	0.0002079	Pa×s	559.58	Calculated Property
η	0.0001581	Pa×s	591.82	Calculated Property
η	0.0001236	Pa×s	624.06	Calculated Property
η	0.0000990	Pa×s	656.30	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, cyclohexylmethyl hept-1,6-dien-4-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

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.
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