Chemical Properties of 3-Cyclopentylpropionic acid, 4-methoxy-2-methylbutyl ester

InChI

InChI=1S/C14H26O3/c1-12(9-10-16-2)11-17-14(15)8-7-13-5-3-4-6-13/h12-13H,3-11H2,1-2H3

InChI Key

QBAANVKOMZFPGW-UHFFFAOYSA-N

Formula

C14H26O3

SMILES

COCCC(C)COC(=O)CCC1CCCC1

Molecular Weight¹

242.35

• 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

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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[580.03; 681.42]	J/mol×K	[615.40; 803.82]
Cp,gas	580.03	J/mol×K	615.40	Joback Calculated Property
Cp,gas	599.35	J/mol×K	646.80	Joback Calculated Property
Cp,gas	617.69	J/mol×K	678.21	Joback Calculated Property
Cp,gas	635.05	J/mol×K	709.61	Joback Calculated Property
Cp,gas	651.45	J/mol×K	741.01	Joback Calculated Property
Cp,gas	666.90	J/mol×K	772.42	Joback Calculated Property
Cp,gas	681.42	J/mol×K	803.82	Joback Calculated Property
η	[0.0001426; 0.0042221]	Pa×s	[308.00; 615.40]
η	0.0042221	Pa×s	308.00	Joback Calculated Property
η	0.0016047	Pa×s	359.23	Joback Calculated Property
η	0.0007765	Pa×s	410.47	Joback Calculated Property
η	0.0004414	Pa×s	461.70	Joback Calculated Property
η	0.0002809	Pa×s	512.93	Joback Calculated Property
η	0.0001940	Pa×s	564.17	Joback Calculated Property
η	0.0001426	Pa×s	615.40	Joback Calculated Property

Similar Compounds

Find more compounds similar to 3-Cyclopentylpropionic acid, 4-methoxy-2-methylbutyl 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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