Chemical Properties of Glutaric acid, di(3,4,5-trichlorophenyl) ester

InChI

InChI=1S/C17H10Cl6O4/c18-10-4-8(5-11(19)16(10)22)26-14(24)2-1-3-15(25)27-9-6-12(20)17(23)13(21)7-9/h4-7H,1-3H2

InChI Key

SDPREOAAEMBCNH-UHFFFAOYSA-N

Formula

C17H10Cl6O4

SMILES

O=C(CCCC(=O)Oc1cc(Cl)c(Cl)c(Cl)c1)Oc1cc(Cl)c(Cl)c(Cl)c1

Molecular Weight¹

490.98

• 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).
• 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°	59.45	kJ/mol	Joback Calculated Property
logPoct/wat	7.288		Crippen Calculated Property
McVol	291.190	ml/mol	McGowan Calculated Property
Inp	[3597.00; 3597.00]
Inp	3597.00		NIST
Inp	3597.00		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, 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[380.01; 706.92]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			1.33583e+02
Coefficient B			1.03520e+00
Coefficient C			-4.94360e-04
Coefficient D			3.25000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	380.01	J/mol×K	273.00	Calculated Property
Cp,gas	439.38	J/mol×K	353.78	Calculated Property
Cp,gas	492.75	J/mol×K	434.56	Calculated Property
Cp,gas	540.22	J/mol×K	515.33	Calculated Property
Cp,gas	581.89	J/mol×K	596.11	Calculated Property
Cp,gas	617.87	J/mol×K	676.89	Calculated Property
Cp,gas	648.26	J/mol×K	757.67	Calculated Property
Cp,gas	673.17	J/mol×K	838.44	Calculated Property
Cp,gas	692.69	J/mol×K	919.22	Calculated Property
Cp,gas	706.92	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0001558; 0.0000457]	Pa×s	[673.49; 883.40]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.39306e+01
Coefficient B			3.47780e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			673.49
Temperature range, max.			883.40
η	0.0001558	Pa×s	673.49	Calculated Property
η	0.0001311	Pa×s	696.81	Calculated Property
η	0.0001115	Pa×s	720.14	Calculated Property
η	0.0000958	Pa×s	743.46	Calculated Property
η	0.0000831	Pa×s	766.78	Calculated Property
η	0.0000727	Pa×s	790.11	Calculated Property
η	0.0000641	Pa×s	813.43	Calculated Property
η	0.0000569	Pa×s	836.75	Calculated Property
η	0.0000508	Pa×s	860.08	Calculated Property
η	0.0000457	Pa×s	883.40	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, di(3,4,5-trichlorophenyl) 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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