Chemical Properties of Glutaric acid, cyclohexylmethyl 2-ethylbutyl ester

InChI

InChI=1S/C18H32O4/c1-3-15(4-2)13-21-17(19)11-8-12-18(20)22-14-16-9-6-5-7-10-16/h15-16H,3-14H2,1-2H3

InChI Key

WGFDHNRRDWGGIK-UHFFFAOYSA-N

Formula

C18H32O4

SMILES

CCC(CC)COC(=O)CCCC(=O)OCC1CCCCC1

Molecular Weight¹

312.44

• 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).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	36.26	kJ/mol	Joback Calculated Property
log10WS	-4.28		Relay (1.0) Calculated Property
logPoct/wat	4.260		Crippen Calculated Property
McVol	268.500	ml/mol	McGowan Calculated Property
Inp	[2200.00; 2200.00]
Inp	2200.00		NIST
Inp	2200.00		NIST
Tfus	237.72	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, 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 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[846.45; 941.36]	J/mol×K	[782.93; 980.01]
Cp,gas	846.45	J/mol×K	782.93	Joback Calculated Property
Cp,gas	865.30	J/mol×K	815.78	Joback Calculated Property
Cp,gas	882.92	J/mol×K	848.62	Joback Calculated Property
Cp,gas	899.31	J/mol×K	881.47	Joback Calculated Property
Cp,gas	914.51	J/mol×K	914.31	Joback Calculated Property
Cp,gas	928.52	J/mol×K	947.16	Joback Calculated Property
Cp,gas	941.36	J/mol×K	980.01	Joback Calculated Property
η	[0.0000675; 0.0014323]	Pa×s	[429.32; 782.93]
η	0.0014323	Pa×s	429.32	Joback Calculated Property
η	0.0006331	Pa×s	488.25	Joback Calculated Property
η	0.0003336	Pa×s	547.19	Joback Calculated Property
η	0.0001991	Pa×s	606.12	Joback Calculated Property
η	0.0001302	Pa×s	665.06	Joback Calculated Property
η	0.0000913	Pa×s	723.99	Joback Calculated Property
η	0.0000675	Pa×s	782.93	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, cyclohexylmethyl 2-ethylbutyl 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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