Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, decyl 2-ethoxyethyl ester

InChI

InChI=1S/C22H40O5/c1-3-5-6-7-8-9-10-13-16-26-21(23)19-14-11-12-15-20(19)22(24)27-18-17-25-4-2/h19-20H,3-18H2,1-2H3

InChI Key

HCXGDTBLFYGQMQ-UHFFFAOYSA-N

Formula

C22H40O5

SMILES

CCCCCCCCCCOC(=O)C1CCCCC1C(=O)OCCOCC

Molecular Weight¹

384.55

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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
ω	0.9844		Relay (1.0) Calculated Property
ΔfG°	-421.74	kJ/mol	Joback Calculated Property
ΔfH°gas	-1170.46	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	52.40	kJ/mol	Joback Calculated Property
ΔvapH°	108.71	kJ/mol	Relay (1.0) Calculated Property
IE	9.48	eV	Relay (1.0) Calculated Property
log10WS	-5.10		Relay (1.0) Calculated Property
logPoct/wat	5.056		Crippen Calculated Property
McVol	330.730	ml/mol	McGowan Calculated Property
Pc	1052.09	kPa	Joback Calculated Property
Inp	[2595.00; 2595.00]
Inp	2595.00		NIST
Inp	2595.00		NIST
Tboil	646.56	K	Relay (1.0) Calculated Property
Tc	847.98	K	Relay (1.0) Calculated Property
Tfus	287.64	K	Relay (1.0) Calculated Property
Vc	1.220	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1124.90; 1214.82]	J/mol×K	[892.64; 1094.65]
Cp,gas	1124.90	J/mol×K	892.64	Joback Calculated Property
Cp,gas	1143.76	J/mol×K	926.31	Joback Calculated Property
Cp,gas	1161.06	J/mol×K	959.98	Joback Calculated Property
Cp,gas	1176.80	J/mol×K	993.64	Joback Calculated Property
Cp,gas	1191.00	J/mol×K	1027.31	Joback Calculated Property
Cp,gas	1203.67	J/mol×K	1060.98	Joback Calculated Property
Cp,gas	1214.82	J/mol×K	1094.65	Joback Calculated Property
η	[0.0000398; 0.0005641]	Pa×s	[507.39; 892.64]
η	0.0005641	Pa×s	507.39	Joback Calculated Property
η	0.0002829	Pa×s	571.60	Joback Calculated Property
η	0.0001631	Pa×s	635.81	Joback Calculated Property
η	0.0001040	Pa×s	700.01	Joback Calculated Property
η	0.0000716	Pa×s	764.22	Joback Calculated Property
η	0.0000522	Pa×s	828.43	Joback Calculated Property
η	0.0000398	Pa×s	892.64	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, decyl 2-ethoxyethyl ester.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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