Chemical Properties of cis-Cyclohex-4-en-1,2-dicarboxylic acid, ethyl 2-ethylbutyl ester

InChI

InChI=1S/C16H26O4/c1-4-12(5-2)11-20-16(18)14-10-8-7-9-13(14)15(17)19-6-3/h7-8,12-14H,4-6,9-11H2,1-3H3

InChI Key

UNRCMOQMXSQDKE-UHFFFAOYSA-N

Formula

C16H26O4

SMILES

CCOC(=O)C1CC=CCC1C(=O)OCC(CC)CC

Molecular Weight¹

282.38

• 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°	-339.74	kJ/mol	Joback Calculated Property
ΔfH°gas	-776.69	kJ/mol	Joback Calculated Property
ΔfusH°	33.37	kJ/mol	Joback Calculated Property
ΔvapH°	69.55	kJ/mol	Joback Calculated Property
log10WS	-3.27		Crippen Calculated Property
logPoct/wat	3.111		Crippen Calculated Property
McVol	236.020	ml/mol	McGowan Calculated Property
Pc	1671.43	kPa	Joback Calculated Property
Inp	[1866.00; 1866.00]
Inp	1866.00		NIST
Inp	1866.00		NIST
Tboil	731.66	K	Joback Calculated Property
Tc	931.82	K	Joback Calculated Property
Tfus	403.30	K	Joback Calculated Property
Vc	0.891	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[706.67; 798.70]	J/mol×K	[731.66; 931.82]
Cp,gas	706.67	J/mol×K	731.66	Joback Calculated Property
Cp,gas	724.87	J/mol×K	765.02	Joback Calculated Property
Cp,gas	741.91	J/mol×K	798.38	Joback Calculated Property
Cp,gas	757.81	J/mol×K	831.74	Joback Calculated Property
Cp,gas	772.57	J/mol×K	865.10	Joback Calculated Property
Cp,gas	786.20	J/mol×K	898.46	Joback Calculated Property
Cp,gas	798.70	J/mol×K	931.82	Joback Calculated Property
η	[0.0001171; 0.0016405]	Pa×s	[403.30; 731.66]
η	0.0016405	Pa×s	403.30	Joback Calculated Property
η	0.0008124	Pa×s	458.03	Joback Calculated Property
η	0.0004674	Pa×s	512.75	Joback Calculated Property
η	0.0002992	Pa×s	567.48	Joback Calculated Property
η	0.0002071	Pa×s	622.21	Joback Calculated Property
η	0.0001522	Pa×s	676.93	Joback Calculated Property
η	0.0001171	Pa×s	731.66	Joback Calculated Property

Similar Compounds

Find more compounds similar to cis-Cyclohex-4-en-1,2-dicarboxylic acid, ethyl 2-ethylbutyl ester.

Sources

• 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.