Chemical Properties of Glutaric acid, 8-chlorooctyl 2,3-dichlorophenyl ester

InChI

InChI=1S/C19H25Cl3O4/c20-13-5-3-1-2-4-6-14-25-17(23)11-8-12-18(24)26-16-10-7-9-15(21)19(16)22/h7,9-10H,1-6,8,11-14H2

InChI Key

YMDOBJNWMYJWQB-UHFFFAOYSA-N

Formula

C19H25Cl3O4

SMILES

O=C(CCCC(=O)Oc1cccc(Cl)c1Cl)OCCCCCCCCCl

Molecular Weight¹

423.76

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• 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
ΔfH°gas	-877.22	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	59.56	kJ/mol	Joback Calculated Property
ΔvapH°	119.00	kJ/mol	Relay (1.0) Calculated Property
logPoct/wat	6.192		Crippen Calculated Property
McVol	306.410	ml/mol	McGowan Calculated Property
Inp	[3084.00; 3084.00]
Inp	3084.00		NIST
Inp	3084.00		NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, 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	[883.67; 940.60]	J/mol×K	[899.69; 1110.04]
Cp,gas	883.67	J/mol×K	899.69	Joback Calculated Property
Cp,gas	896.07	J/mol×K	934.75	Joback Calculated Property
Cp,gas	907.28	J/mol×K	969.81	Joback Calculated Property
Cp,gas	917.30	J/mol×K	1004.87	Joback Calculated Property
Cp,gas	926.18	J/mol×K	1039.92	Joback Calculated Property
Cp,gas	933.94	J/mol×K	1074.98	Joback Calculated Property
Cp,gas	940.60	J/mol×K	1110.04	Joback Calculated Property
η	[0.0000307; 0.0004049]	Pa×s	[529.77; 899.69]
η	0.0004049	Pa×s	529.77	Joback Calculated Property
η	0.0002105	Pa×s	591.42	Joback Calculated Property
η	0.0001239	Pa×s	653.08	Joback Calculated Property
η	0.0000798	Pa×s	714.73	Joback Calculated Property
η	0.0000552	Pa×s	776.38	Joback Calculated Property
η	0.0000403	Pa×s	838.04	Joback Calculated Property
η	0.0000307	Pa×s	899.69	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 8-chlorooctyl 2,3-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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