Chemical Properties of Succinic acid, cyclohexylmethyl phenethyl ester

InChI

InChI=1S/C19H26O4/c20-18(22-14-13-16-7-3-1-4-8-16)11-12-19(21)23-15-17-9-5-2-6-10-17/h1,3-4,7-8,17H,2,5-6,9-15H2

InChI Key

VPAOUODPXPXCKS-UHFFFAOYSA-N

Formula

C19H26O4

SMILES

O=C(CCC(=O)OCC1CCCCC1)OCCc1ccccc1

Molecular Weight¹

318.41

• 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).
• Δ_vapH° : Enthalpy of vaporization 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation 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	[345.84; 882.32]	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			-6.30750e+01
Coefficient B			1.74240e+00
Coefficient C			-9.32800e-04
Coefficient D			1.35800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	345.84	J/mol×K	273.00	Calculated Property
Cp,gas	442.61	J/mol×K	353.78	Calculated Property
Cp,gas	529.09	J/mol×K	434.56	Calculated Property
Cp,gas	605.70	J/mol×K	515.33	Calculated Property
Cp,gas	672.89	J/mol×K	596.11	Calculated Property
Cp,gas	731.06	J/mol×K	676.89	Calculated Property
Cp,gas	780.67	J/mol×K	757.67	Calculated Property
Cp,gas	822.13	J/mol×K	838.44	Calculated Property
Cp,gas	855.87	J/mol×K	919.22	Calculated Property
Cp,gas	882.32	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0014842; 0.0000809]	Pa×s	[422.35; 709.40]	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			-1.37027e+01
Coefficient B			3.03661e+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.			422.35
Temperature range, max.			709.40
η	0.0014842	Pa×s	422.35	Calculated Property
η	0.0008959	Pa×s	454.24	Calculated Property
η	0.0005778	Pa×s	486.14	Calculated Property
η	0.0003933	Pa×s	518.03	Calculated Property
η	0.0002800	Pa×s	549.93	Calculated Property
η	0.0002068	Pa×s	581.82	Calculated Property
η	0.0001577	Pa×s	613.72	Calculated Property
η	0.0001235	Pa×s	645.61	Calculated Property
η	0.0000990	Pa×s	677.51	Calculated Property
η	0.0000809	Pa×s	709.40	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, cyclohexylmethyl phenethyl 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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