Chemical Properties of Diglycolic acid, di(2,6-dichlorophenyl) ester

InChI

InChI=1S/C16H10Cl4O5/c17-9-3-1-4-10(18)15(9)24-13(21)7-23-8-14(22)25-16-11(19)5-2-6-12(16)20/h1-6H,7-8H2

InChI Key

ZPQQCOKUFJXGTG-UHFFFAOYSA-N

Formula

C16H10Cl4O5

SMILES

O=C(COCC(=O)Oc1c(Cl)cccc1Cl)Oc1c(Cl)cccc1Cl

Molecular Weight¹

424.06

• 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.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	50.44	kJ/mol	Joback Calculated Property
IE	8.49	eV	Relay (1.0) Calculated Property
log10WS	-5.78		Relay (1.0) Calculated Property
logPoct/wat	4.828		Crippen Calculated Property
McVol	258.490	ml/mol	McGowan Calculated Property
Inp	[3508.00; 3508.00]
Inp	3508.00		NIST
Inp	3508.00		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 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	[651.65; 673.17]	J/mol×K	[927.54; 1169.85]
Cp,gas	651.65	J/mol×K	927.54	Joback Calculated Property
Cp,gas	658.74	J/mol×K	967.92	Joback Calculated Property
Cp,gas	664.43	J/mol×K	1008.31	Joback Calculated Property
Cp,gas	668.72	J/mol×K	1048.69	Joback Calculated Property
Cp,gas	671.61	J/mol×K	1089.08	Joback Calculated Property
Cp,gas	673.09	J/mol×K	1129.46	Joback Calculated Property
Cp,gas	673.17	J/mol×K	1169.85	Joback Calculated Property
η	[0.0000322; 0.0002210]	Pa×s	[599.57; 927.54]
η	0.0002210	Pa×s	599.57	Joback Calculated Property
η	0.0001402	Pa×s	654.23	Joback Calculated Property
η	0.0000954	Pa×s	708.89	Joback Calculated Property
η	0.0000686	Pa×s	763.56	Joback Calculated Property
η	0.0000515	Pa×s	818.22	Joback Calculated Property
η	0.0000401	Pa×s	872.88	Joback Calculated Property
η	0.0000322	Pa×s	927.54	Joback Calculated Property

Similar Compounds

Find more compounds similar to Diglycolic acid, di(2,6-dichlorophenyl) 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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