Chemical Properties of Glutaric acid, 2,3-dichlorophenyl 2,4-dimethylpent-3-yl ester

InChI

InChI=1S/C18H24Cl2O4/c1-11(2)18(12(3)4)24-16(22)10-6-9-15(21)23-14-8-5-7-13(19)17(14)20/h5,7-8,11-12,18H,6,9-10H2,1-4H3

InChI Key

HRCFEXPYMZABAK-UHFFFAOYSA-N

Formula

C18H24Cl2O4

SMILES

CC(C)C(OC(=O)CCCC(=O)Oc1cccc(Cl)c1Cl)C(C)C

Molecular Weight¹

375.29

• 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°	42.20	kJ/mol	Joback Calculated Property
logPoct/wat	5.293		Crippen Calculated Property
McVol	280.080	ml/mol	McGowan Calculated Property
Inp	[2477.00; 2477.00]
Inp	2477.00		NIST
Inp	2477.00		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	[393.71; 857.73]	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			5.27730e+01
Coefficient B			1.43768e+00
Coefficient C			-7.13720e-04
Coefficient D			8.10000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	393.71	J/mol×K	273.00	Calculated Property
Cp,gas	475.65	J/mol×K	353.78	Calculated Property
Cp,gas	549.39	J/mol×K	434.56	Calculated Property
Cp,gas	615.20	J/mol×K	515.33	Calculated Property
Cp,gas	673.33	J/mol×K	596.11	Calculated Property
Cp,gas	724.03	J/mol×K	676.89	Calculated Property
Cp,gas	767.57	J/mol×K	757.67	Calculated Property
Cp,gas	804.19	J/mol×K	838.44	Calculated Property
Cp,gas	834.16	J/mol×K	919.22	Calculated Property
Cp,gas	857.73	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0009435; 0.0000555]	Pa×s	[443.58; 734.73]	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			-1.41163e+01
Coefficient B			3.17176e+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.			443.58
Temperature range, max.			734.73
η	0.0009435	Pa×s	443.58	Calculated Property
η	0.0005803	Pa×s	475.93	Calculated Property
η	0.0003797	Pa×s	508.28	Calculated Property
η	0.0002614	Pa×s	540.63	Calculated Property
η	0.0001877	Pa×s	572.98	Calculated Property
η	0.0001396	Pa×s	605.33	Calculated Property
η	0.0001070	Pa×s	637.68	Calculated Property
η	0.0000842	Pa×s	670.03	Calculated Property
η	0.0000677	Pa×s	702.38	Calculated Property
η	0.0000555	Pa×s	734.73	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,3-dichlorophenyl 2,4-dimethylpent-3-yl 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.
These property values are available through the Cheméo API. A free account gives you an access key.