Chemical Properties of Glutaric acid, 2-chlorophenyl dodecyl ester

InChI

InChI=1S/C23H35ClO4/c1-2-3-4-5-6-7-8-9-10-13-19-27-22(25)17-14-18-23(26)28-21-16-12-11-15-20(21)24/h11-12,15-16H,2-10,13-14,17-19H2,1H3

InChI Key

VBISWWUMIXIQNY-UHFFFAOYSA-N

Formula

C23H35ClO4

SMILES

CCCCCCCCCCCCOC(=O)CCCC(=O)Oc1ccccc1Cl

Molecular Weight¹

410.98

• 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).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-923.98	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	58.75	kJ/mol	Joback Calculated Property
ΔvapH°	118.18	kJ/mol	Relay (1.0) Calculated Property
IE	8.70	eV	Relay (1.0) Calculated Property
log10WS	-6.72		Relay (1.0) Calculated Property
logPoct/wat	6.880		Crippen Calculated Property
McVol	338.290	ml/mol	McGowan Calculated Property
Pc	1071.46	kPa	Joback Calculated Property
Inp	[3026.00; 3026.00]
Inp	3026.00		NIST
Inp	3026.00		NIST
Tboil	657.26	K	Relay (1.0) Calculated Property
Tc	876.74	K	Relay (1.0) Calculated Property
Tfus	311.87	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor 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	[1084.97; 1159.55]	J/mol×K	[947.31; 1160.48]
Cp,gas	1084.97	J/mol×K	947.31	Joback Calculated Property
Cp,gas	1100.59	J/mol×K	982.84	Joback Calculated Property
Cp,gas	1114.89	J/mol×K	1018.37	Joback Calculated Property
Cp,gas	1127.90	J/mol×K	1053.89	Joback Calculated Property
Cp,gas	1139.65	J/mol×K	1089.42	Joback Calculated Property
Cp,gas	1150.19	J/mol×K	1124.95	Joback Calculated Property
Cp,gas	1159.55	J/mol×K	1160.48	Joback Calculated Property
η	[0.0000303; 0.0003455]	Pa×s	[562.15; 947.31]
η	0.0003455	Pa×s	562.15	Joback Calculated Property
η	0.0001870	Pa×s	626.34	Joback Calculated Property
η	0.0001135	Pa×s	690.54	Joback Calculated Property
η	0.0000750	Pa×s	754.73	Joback Calculated Property
η	0.0000529	Pa×s	818.92	Joback Calculated Property
η	0.0000392	Pa×s	883.12	Joback Calculated Property
η	0.0000303	Pa×s	947.31	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2-chlorophenyl dodecyl 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.