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

InChI

InChI=1S/C19H33ClO4/c1-2-3-4-5-6-7-10-14-23-18(21)16-11-8-9-12-17(16)19(22)24-15-13-20/h16-17H,2-15H2,1H3

InChI Key

KLGRZMKDNHJDHJ-UHFFFAOYSA-N

Formula

C19H33ClO4

SMILES

CCCCCCCCCOC(=O)C1CCCCC1C(=O)OCCCl

Molecular Weight¹

360.92

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-1016.17	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	47.64	kJ/mol	Joback Calculated Property
ΔvapH°	100.22	kJ/mol	Relay (1.0) Calculated Property
log10WS	-5.51		Relay (1.0) Calculated Property
logPoct/wat	4.869		Crippen Calculated Property
McVol	294.830	ml/mol	McGowan Calculated Property
Pc	1261.95	kPa	Joback Calculated Property
Inp	[2466.00; 2466.00]
Inp	2466.00		NIST
Inp	2466.00		NIST
Tboil	630.66	K	Relay (1.0) Calculated Property
Tc	850.21	K	Relay (1.0) Calculated Property
Tfus	305.57	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[940.28; 1028.02]	J/mol×K	[839.01; 1038.64]
Cp,gas	940.28	J/mol×K	839.01	Joback Calculated Property
Cp,gas	958.13	J/mol×K	872.28	Joback Calculated Property
Cp,gas	974.67	J/mol×K	905.55	Joback Calculated Property
Cp,gas	989.91	J/mol×K	938.82	Joback Calculated Property
Cp,gas	1003.87	J/mol×K	972.09	Joback Calculated Property
Cp,gas	1016.56	J/mol×K	1005.36	Joback Calculated Property
Cp,gas	1028.02	J/mol×K	1038.64	Joback Calculated Property
η	[0.0000704; 0.0009064]	Pa×s	[481.27; 839.01]
η	0.0009064	Pa×s	481.27	Joback Calculated Property
η	0.0004682	Pa×s	540.89	Joback Calculated Property
η	0.0002758	Pa×s	600.52	Joback Calculated Property
η	0.0001787	Pa×s	660.14	Joback Calculated Property
η	0.0001245	Pa×s	719.76	Joback Calculated Property
η	0.0000916	Pa×s	779.39	Joback Calculated Property
η	0.0000704	Pa×s	839.01	Joback Calculated Property

Similar Compounds

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

Sources

• Cheméo Relay (1.0)
• 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.