Chemical Properties of Succinic acid, cyclohexylmethyl 4-acetylphenyl ester

InChI

InChI=1S/C19H24O5/c1-14(20)16-7-9-17(10-8-16)24-19(22)12-11-18(21)23-13-15-5-3-2-4-6-15/h7-10,15H,2-6,11-13H2,1H3

InChI Key

AWODAOUOPYKZTQ-UHFFFAOYSA-N

Formula

C19H24O5

SMILES

CC(=O)c1ccc(OC(=O)CCC(=O)OCC2CCCCC2)cc1

Molecular Weight¹

332.39

• 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°	40.79	kJ/mol	Joback Calculated Property
logPoct/wat	3.698		Crippen Calculated Property
McVol	260.400	ml/mol	McGowan Calculated Property
Inp	[2789.00; 2789.00]
Inp	2789.00		NIST
Inp	2789.00		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	[349.32; 868.30]	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			-4.14170e+01
Coefficient B			1.65492e+00
Coefficient C			-8.47060e-04
Coefficient D			1.01860e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	349.32	J/mol×K	273.00	Calculated Property
Cp,gas	442.55	J/mol×K	353.78	Calculated Property
Cp,gas	526.14	J/mol×K	434.56	Calculated Property
Cp,gas	600.41	J/mol×K	515.33	Calculated Property
Cp,gas	665.67	J/mol×K	596.11	Calculated Property
Cp,gas	722.27	J/mol×K	676.89	Calculated Property
Cp,gas	770.50	J/mol×K	757.67	Calculated Property
Cp,gas	810.71	J/mol×K	838.44	Calculated Property
Cp,gas	843.20	J/mol×K	919.22	Calculated Property
Cp,gas	868.30	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0008666; 0.0000796]	Pa×s	[484.80; 755.36]	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			-1.37167e+01
Coefficient B			3.23154e+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.			484.80
Temperature range, max.			755.36
η	0.0008666	Pa×s	484.80	Calculated Property
η	0.0005872	Pa×s	514.86	Calculated Property
η	0.0004153	Pa×s	544.92	Calculated Property
η	0.0003046	Pa×s	574.99	Calculated Property
η	0.0002304	Pa×s	605.05	Calculated Property
η	0.0001789	Pa×s	635.11	Calculated Property
η	0.0001422	Pa×s	665.17	Calculated Property
η	0.0001152	Pa×s	695.23	Calculated Property
η	0.0000950	Pa×s	725.29	Calculated Property
η	0.0000796	Pa×s	755.36	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, cyclohexylmethyl 4-acetylphenyl 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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