Chemical Properties of Succinic acid, 8-chlorooctyl tetrahydrofurfuryl ester

InChI

InChI=1S/C17H29ClO5/c18-11-5-3-1-2-4-6-12-22-16(19)9-10-17(20)23-14-15-8-7-13-21-15/h15H,1-14H2

InChI Key

RPOFSNZQGXQAKX-UHFFFAOYSA-N

Formula

C17H29ClO5

SMILES

O=C(CCC(=O)OCC1CCCO1)OCCCCCCCCCl

Molecular Weight¹

348.87

• 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.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	54.63	kJ/mol	Joback Calculated Property
logPoct/wat	3.611		Crippen Calculated Property
McVol	272.520	ml/mol	McGowan Calculated Property
Inp	[2658.00; 2658.00]
Inp	2658.00		NIST
Inp	2658.00		NIST
Tboil	636.42	K	Relay (1.0) Calculated Property

Cheméo can also estimate 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	[396.33; 923.68]	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			7.98100e+00
Coefficient B			1.64470e+00
Coefficient C			-8.45700e-04
Coefficient D			1.16700e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	396.33	J/mol×K	273.00	Calculated Property
Cp,gas	489.16	J/mol×K	353.78	Calculated Property
Cp,gas	572.57	J/mol×K	434.56	Calculated Property
Cp,gas	646.93	J/mol×K	515.33	Calculated Property
Cp,gas	712.61	J/mol×K	596.11	Calculated Property
Cp,gas	769.97	J/mol×K	676.89	Calculated Property
Cp,gas	819.39	J/mol×K	757.67	Calculated Property
Cp,gas	861.24	J/mol×K	838.44	Calculated Property
Cp,gas	895.88	J/mol×K	919.22	Calculated Property
Cp,gas	923.68	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0015695; 0.0001245]	Pa×s	[433.40; 683.69]	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			-1.33783e+01
Coefficient B			2.99969e+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.			433.40
Temperature range, max.			683.69
η	0.0015695	Pa×s	433.40	Calculated Property
η	0.0010340	Pa×s	461.21	Calculated Property
η	0.0007143	Pa×s	489.02	Calculated Property
η	0.0005135	Pa×s	516.83	Calculated Property
η	0.0003818	Pa×s	544.64	Calculated Property
η	0.0002922	Pa×s	572.45	Calculated Property
η	0.0002292	Pa×s	600.26	Calculated Property
η	0.0001837	Pa×s	628.07	Calculated Property
η	0.0001500	Pa×s	655.88	Calculated Property
η	0.0001245	Pa×s	683.69	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 8-chlorooctyl tetrahydrofurfuryl 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

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