Chemical Properties of Glutaric acid, di(4-chloro-2-methoxyphenyl) ester

InChI

InChI=1S/C19H18Cl2O6/c1-24-16-10-12(20)6-8-14(16)26-18(22)4-3-5-19(23)27-15-9-7-13(21)11-17(15)25-2/h6-11H,3-5H2,1-2H3

InChI Key

ZNELHFVDPOZCRQ-UHFFFAOYSA-N

Formula

C19H18Cl2O6

SMILES

COc1cc(Cl)ccc1OC(=O)CCCC(=O)Oc1ccc(Cl)cc1OC

Molecular Weight¹

413.25

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

Physical Properties

Property	Value	Unit	Source
ΔfusH°	51.00	kJ/mol	Joback Calculated Property
IE	8.00	eV	Relay (1.0) Calculated Property
log10WS	-5.25		Relay (1.0) Calculated Property
logPoct/wat	4.692		Crippen Calculated Property
McVol	282.150	ml/mol	McGowan Calculated Property
Inp	[3119.00; 3119.00]
Inp	3119.00		NIST
Inp	3119.00		NIST
Tboil	684.38	K	Relay (1.0) Calculated Property
Tfus	386.92	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 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	[806.84; 838.82]	J/mol×K	[943.74; 1173.36]
Cp,gas	806.84	J/mol×K	943.74	Joback Calculated Property
Cp,gas	816.24	J/mol×K	982.01	Joback Calculated Property
Cp,gas	824.03	J/mol×K	1020.28	Joback Calculated Property
Cp,gas	830.20	J/mol×K	1058.55	Joback Calculated Property
Cp,gas	834.73	J/mol×K	1096.82	Joback Calculated Property
Cp,gas	837.60	J/mol×K	1135.09	Joback Calculated Property
Cp,gas	838.82	J/mol×K	1173.36	Joback Calculated Property
η	[0.0000213; 0.0001666]	Pa×s	[595.77; 943.74]
η	0.0001666	Pa×s	595.77	Joback Calculated Property
η	0.0001015	Pa×s	653.76	Joback Calculated Property
η	0.0000671	Pa×s	711.76	Joback Calculated Property
η	0.0000472	Pa×s	769.75	Joback Calculated Property
η	0.0000348	Pa×s	827.75	Joback Calculated Property
η	0.0000268	Pa×s	885.75	Joback Calculated Property
η	0.0000213	Pa×s	943.74	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, di(4-chloro-2-methoxyphenyl) 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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