Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, methyl nonyl ester

InChI

InChI=1S/C18H32O4/c1-3-4-5-6-7-8-11-14-22-18(20)16-13-10-9-12-15(16)17(19)21-2/h15-16H,3-14H2,1-2H3

InChI Key

GMQVRUPLASKXOR-UHFFFAOYSA-N

Formula

C18H32O4

SMILES

CCCCCCCCCOC(=O)C1CCCCC1C(=O)OC

Molecular Weight¹

312.44

• 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	0.8050		Relay (1.0) Calculated Property
ΔfG°	-350.42	kJ/mol	Joback Calculated Property
ΔfH°gas	-960.43	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	40.86	kJ/mol	Joback Calculated Property
ΔvapH°	95.72	kJ/mol	Relay (1.0) Calculated Property
IE	9.62	eV	Relay (1.0) Calculated Property
log10WS	-4.81		Relay (1.0) Calculated Property
logPoct/wat	4.260		Crippen Calculated Property
McVol	268.500	ml/mol	McGowan Calculated Property
Pc	1390.22	kPa	Joback Calculated Property
Inp	[2178.00; 2178.00]
Inp	2178.00		NIST
Inp	2178.00		NIST
Tboil	600.13	K	Relay (1.0) Calculated Property
Tc	810.55	K	Relay (1.0) Calculated Property
Tfus	304.66	K	Relay (1.0) Calculated Property
Vc	0.986	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[848.78; 944.86]	J/mol×K	[778.70; 973.21]
Cp,gas	848.78	J/mol×K	778.70	Joback Calculated Property
Cp,gas	867.82	J/mol×K	811.12	Joback Calculated Property
Cp,gas	885.63	J/mol×K	843.54	Joback Calculated Property
Cp,gas	902.23	J/mol×K	875.95	Joback Calculated Property
Cp,gas	917.63	J/mol×K	908.37	Joback Calculated Property
Cp,gas	931.83	J/mol×K	940.79	Joback Calculated Property
Cp,gas	944.86	J/mol×K	973.21	Joback Calculated Property
η	[0.0000926; 0.0012314]	Pa×s	[440.08; 778.70]
η	0.0012314	Pa×s	440.08	Joback Calculated Property
η	0.0006262	Pa×s	496.52	Joback Calculated Property
η	0.0003655	Pa×s	552.95	Joback Calculated Property
η	0.0002358	Pa×s	609.39	Joback Calculated Property
η	0.0001638	Pa×s	665.83	Joback Calculated Property
η	0.0001205	Pa×s	722.26	Joback Calculated Property
η	0.0000926	Pa×s	778.70	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, methyl nonyl ester.

Sources

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

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