Chemical Properties of Glutaric acid, di(3,4-dimethylphenyl) ester

InChI

InChI=1S/C21H24O4/c1-14-8-10-18(12-16(14)3)24-20(22)6-5-7-21(23)25-19-11-9-15(2)17(4)13-19/h8-13H,5-7H2,1-4H3

InChI Key

SQMUBERKHRGVAS-UHFFFAOYSA-N

Formula

C21H24O4

SMILES

Cc1ccc(OC(=O)CCCC(=O)Oc2ccc(C)c(C)c2)cc1C

Molecular Weight¹

340.41

• 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).
• 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).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	45.41	kJ/mol	Joback Calculated Property
logPoct/wat	4.602		Crippen Calculated Property
McVol	274.110	ml/mol	McGowan Calculated Property
Inp	[2875.00; 2875.00]
Inp	2875.00		NIST
Inp	2875.00		NIST
Tboil	664.19	K	Relay (1.0) Calculated Property
Tfus	372.27	K	Relay (1.0) Calculated Property

Cheméo can also estimate 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	[825.51; 890.50]	J/mol×K	[869.80; 1090.38]
Cp,gas	825.51	J/mol×K	869.80	Joback Calculated Property
Cp,gas	839.76	J/mol×K	906.56	Joback Calculated Property
Cp,gas	852.61	J/mol×K	943.33	Joback Calculated Property
Cp,gas	864.09	J/mol×K	980.09	Joback Calculated Property
Cp,gas	874.22	J/mol×K	1016.85	Joback Calculated Property
Cp,gas	883.01	J/mol×K	1053.61	Joback Calculated Property
Cp,gas	890.50	J/mol×K	1090.38	Joback Calculated Property
η	[0.0000391; 0.0004023]	Pa×s	[514.01; 869.80]
η	0.0004023	Pa×s	514.01	Joback Calculated Property
η	0.0002231	Pa×s	573.31	Joback Calculated Property
η	0.0001382	Pa×s	632.61	Joback Calculated Property
η	0.0000929	Pa×s	691.90	Joback Calculated Property
η	0.0000665	Pa×s	751.20	Joback Calculated Property
η	0.0000500	Pa×s	810.50	Joback Calculated Property
η	0.0000391	Pa×s	869.80	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, di(3,4-dimethylphenyl) 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.
These property values are available through the Cheméo API. A free account gives you an access key.