Chemical Properties of Glutaric acid, 2,2-dichloroethyl 4-chloro-2-methoxyphenyl ester

InChI

InChI=1S/C14H15Cl3O5/c1-20-11-7-9(15)5-6-10(11)22-14(19)4-2-3-13(18)21-8-12(16)17/h5-7,12H,2-4,8H2,1H3

InChI Key

XSDKLDUDSXYTFN-UHFFFAOYSA-N

Formula

C14H15Cl3O5

SMILES

COc1cc(Cl)ccc1OC(=O)CCCC(=O)OCC(Cl)Cl

Molecular Weight¹

369.62

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	-450.92	kJ/mol	Joback Calculated Property
ΔfH°gas	-793.02	kJ/mol	Joback Calculated Property
ΔfusH°	41.11	kJ/mol	Joback Calculated Property
ΔvapH°	83.85	kJ/mol	Joback Calculated Property
log10WS	-4.46		Crippen Calculated Property
logPoct/wat	3.771		Crippen Calculated Property
McVol	241.830	ml/mol	McGowan Calculated Property
Pc	1908.57	kPa	Joback Calculated Property
Inp	[2521.00; 2521.00]
Inp	2521.00		NIST
Inp	2521.00		NIST
Tboil	843.21	K	Joback Calculated Property
Tc	1061.97	K	Joback Calculated Property
Tfus	540.31	K	Joback Calculated Property
Vc	0.918	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[637.19; 685.74]	J/mol×K	[843.21; 1061.97]
Cp,gas	637.19	J/mol×K	843.21	Joback Calculated Property
Cp,gas	647.93	J/mol×K	879.67	Joback Calculated Property
Cp,gas	657.62	J/mol×K	916.13	Joback Calculated Property
Cp,gas	666.25	J/mol×K	952.59	Joback Calculated Property
Cp,gas	673.82	J/mol×K	989.05	Joback Calculated Property
Cp,gas	680.32	J/mol×K	1025.51	Joback Calculated Property
Cp,gas	685.74	J/mol×K	1061.97	Joback Calculated Property
η	[0.0000574; 0.0004136]	Pa×s	[540.31; 843.21]
η	0.0004136	Pa×s	540.31	Joback Calculated Property
η	0.0002586	Pa×s	590.79	Joback Calculated Property
η	0.0001741	Pa×s	641.28	Joback Calculated Property
η	0.0001241	Pa×s	691.76	Joback Calculated Property
η	0.0000927	Pa×s	742.24	Joback Calculated Property
η	0.0000719	Pa×s	792.73	Joback Calculated Property
η	0.0000574	Pa×s	843.21	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,2-dichloroethyl 4-chloro-2-methoxyphenyl ester.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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