Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, 2,5-dichlorophenyl propyl ester

InChI

InChI=1S/C17H20Cl2O4/c1-2-9-22-16(20)12-5-3-4-6-13(12)17(21)23-15-10-11(18)7-8-14(15)19/h7-8,10,12-13H,2-6,9H2,1H3

InChI Key

JFGWRJVIDRNNTK-UHFFFAOYSA-N

Formula

C17H20Cl2O4

SMILES

CCCOC(=O)C1CCCCC1C(=O)Oc1cc(Cl)ccc1Cl

Molecular Weight¹

359.24

• 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°	-289.55	kJ/mol	Joback Calculated Property
ΔfH°gas	-667.72	kJ/mol	Joback Calculated Property
ΔfusH°	39.92	kJ/mol	Joback Calculated Property
ΔvapH°	84.24	kJ/mol	Joback Calculated Property
log10WS	-5.20		Crippen Calculated Property
logPoct/wat	4.658		Crippen Calculated Property
McVol	255.130	ml/mol	McGowan Calculated Property
Pc	1796.98	kPa	Joback Calculated Property
Inp	[2438.00; 2438.00]
Inp	2438.00		NIST
Inp	2438.00		NIST
Tboil	867.32	K	Joback Calculated Property
Tc	1099.89	K	Joback Calculated Property
Tfus	540.11	K	Joback Calculated Property
Vc	0.958	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[752.80; 815.51]	J/mol×K	[867.32; 1099.89]
Cp,gas	752.80	J/mol×K	867.32	Joback Calculated Property
Cp,gas	766.97	J/mol×K	906.08	Joback Calculated Property
Cp,gas	779.63	J/mol×K	944.84	Joback Calculated Property
Cp,gas	790.80	J/mol×K	983.61	Joback Calculated Property
Cp,gas	800.50	J/mol×K	1022.37	Joback Calculated Property
Cp,gas	808.73	J/mol×K	1061.13	Joback Calculated Property
Cp,gas	815.51	J/mol×K	1099.89	Joback Calculated Property
η	[0.0000853; 0.0006022]	Pa×s	[540.11; 867.32]
η	0.0006022	Pa×s	540.11	Joback Calculated Property
η	0.0003745	Pa×s	594.64	Joback Calculated Property
η	0.0002522	Pa×s	649.18	Joback Calculated Property
η	0.0001806	Pa×s	703.71	Joback Calculated Property
η	0.0001357	Pa×s	758.25	Joback Calculated Property
η	0.0001059	Pa×s	812.78	Joback Calculated Property
η	0.0000853	Pa×s	867.32	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, 2,5-dichlorophenyl propyl ester.

Sources

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

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