Chemical Properties of Glutaric acid, 1-cyclopentylethyl cyclohexylmethyl ester

InChI

InChI=1S/C19H32O4/c1-15(17-10-5-6-11-17)23-19(21)13-7-12-18(20)22-14-16-8-3-2-4-9-16/h15-17H,2-14H2,1H3

InChI Key

SOGGQQDJRAWKGI-UHFFFAOYSA-N

Formula

C19H32O4

SMILES

CC(OC(=O)CCCC(=O)OCC1CCCCC1)C1CCCC1

Molecular Weight¹

324.46

• 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°	35.95	kJ/mol	Joback Calculated Property
logPoct/wat	4.402		Crippen Calculated Property
McVol	271.730	ml/mol	McGowan Calculated Property
Inp	[2334.00; 2334.00]
Inp	2334.00		NIST
Inp	2334.00		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	[369.56; 984.68]	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			-9.13360e+01
Coefficient B			1.95892e+00
Coefficient C			-1.03220e-03
Coefficient D			1.49300e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	369.56	J/mol×K	273.00	Calculated Property
Cp,gas	479.11	J/mol×K	353.78	Calculated Property
Cp,gas	577.26	J/mol×K	434.56	Calculated Property
Cp,gas	664.47	J/mol×K	515.33	Calculated Property
Cp,gas	741.23	J/mol×K	596.11	Calculated Property
Cp,gas	808.01	J/mol×K	676.89	Calculated Property
Cp,gas	865.27	J/mol×K	757.67	Calculated Property
Cp,gas	913.48	J/mol×K	838.44	Calculated Property
Cp,gas	953.13	J/mol×K	919.22	Calculated Property
Cp,gas	984.68	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0029493; 0.0001094]	Pa×s	[391.83; 696.30]	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			-1.33598e+01
Coefficient B			2.95191e+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.			391.83
Temperature range, max.			696.30
η	0.0029493	Pa×s	391.83	Calculated Property
η	0.0016206	Pa×s	425.66	Calculated Property
η	0.0009726	Pa×s	459.49	Calculated Property
η	0.0006260	Pa×s	493.32	Calculated Property
η	0.0004264	Pa×s	527.15	Calculated Property
η	0.0003042	Pa×s	560.98	Calculated Property
η	0.0002255	Pa×s	594.81	Calculated Property
η	0.0001727	Pa×s	628.64	Calculated Property
η	0.0001359	Pa×s	662.47	Calculated Property
η	0.0001094	Pa×s	696.30	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 1-cyclopentylethyl cyclohexylmethyl 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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