Chemical Properties of Diglycolic acid, 2,6-dimethoxyphenyl ethyl ester

InChI

InChI=1S/C14H18O7/c1-4-20-12(15)8-19-9-13(16)21-14-10(17-2)6-5-7-11(14)18-3/h5-7H,4,8-9H2,1-3H3

InChI Key

SEHPFIZSWVJLBI-UHFFFAOYSA-N

Formula

C14H18O7

SMILES

CCOC(=O)COCC(=O)Oc1c(OC)cccc1OC

Molecular Weight¹

298.29

• 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).
• IE : Ionization energy (eV).
• 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_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	37.58	kJ/mol	Joback Calculated Property
IE	8.00	eV	Relay (1.0) Calculated Property
log10WS	-1.87		Relay (1.0) Calculated Property
logPoct/wat	1.189		Crippen Calculated Property
McVol	216.850	ml/mol	McGowan Calculated Property
Inp	[2618.00; 2618.00]
Inp	2618.00		NIST
Inp	2618.00		NIST
Tboil	624.91	K	Relay (1.0) Calculated Property

Cheméo can also estimate 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 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	[609.99; 676.45]	J/mol×K	[740.26; 939.29]
Cp,gas	609.99	J/mol×K	740.26	Joback Calculated Property
Cp,gas	623.68	J/mol×K	773.43	Joback Calculated Property
Cp,gas	636.36	J/mol×K	806.60	Joback Calculated Property
Cp,gas	648.02	J/mol×K	839.77	Joback Calculated Property
Cp,gas	658.60	J/mol×K	872.94	Joback Calculated Property
Cp,gas	668.09	J/mol×K	906.11	Joback Calculated Property
Cp,gas	676.45	J/mol×K	939.29	Joback Calculated Property
η	[0.0000426; 0.0004479]	Pa×s	[450.35; 740.26]
η	0.0004479	Pa×s	450.35	Joback Calculated Property
η	0.0002503	Pa×s	498.67	Joback Calculated Property
η	0.0001550	Pa×s	546.99	Joback Calculated Property
η	0.0001037	Pa×s	595.31	Joback Calculated Property
η	0.0000738	Pa×s	643.62	Joback Calculated Property
η	0.0000550	Pa×s	691.94	Joback Calculated Property
η	0.0000426	Pa×s	740.26	Joback Calculated Property

Similar Compounds

Find more compounds similar to Diglycolic acid, 2,6-dimethoxyphenyl ethyl 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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