Chemical Properties of Succinic acid, trans-hex-3-enyl undecyl ester

InChI

InChI=1S/C21H38O4/c1-3-5-7-9-10-11-12-13-15-19-25-21(23)17-16-20(22)24-18-14-8-6-4-2/h6,8H,3-5,7,9-19H2,1-2H3/b8-6-

InChI Key

UOJFNDCXJUBPSM-SOFGYWHQSA-N

Formula

C21H38O4

SMILES

CC/C=C/CCOC(=O)CCC(=O)OCCCCCCCCCCC

Molecular Weight¹

354.53

• 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	-984.52	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	55.92	kJ/mol	Joback Calculated Property
ΔvapH°	104.83	kJ/mol	Relay (1.0) Calculated Property
IE	9.09	eV	Relay (1.0) Calculated Property
log10WS	-5.69		Relay (1.0) Calculated Property
logPoct/wat	5.740		Crippen Calculated Property
McVol	317.330	ml/mol	McGowan Calculated Property
Pc	1047.33	kPa	Joback Calculated Property
Inp	[2432.00; 2432.00]
Inp	2432.00		NIST
Inp	2432.00		NIST
Tboil	616.13	K	Relay (1.0) Calculated Property
Tc	793.43	K	Relay (1.0) Calculated Property
Tfus	264.93	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	[1004.47; 1097.88]	J/mol×K	[836.62; 1025.83]
Cp,gas	1004.47	J/mol×K	836.62	Joback Calculated Property
Cp,gas	1022.57	J/mol×K	868.16	Joback Calculated Property
Cp,gas	1039.63	J/mol×K	899.69	Joback Calculated Property
Cp,gas	1055.65	J/mol×K	931.23	Joback Calculated Property
Cp,gas	1070.69	J/mol×K	962.76	Joback Calculated Property
Cp,gas	1084.75	J/mol×K	994.30	Joback Calculated Property
Cp,gas	1097.88	J/mol×K	1025.83	Joback Calculated Property
η	[0.0000401; 0.0006985]	Pa×s	[465.67; 836.62]
η	0.0006985	Pa×s	465.67	Joback Calculated Property
η	0.0003282	Pa×s	527.50	Joback Calculated Property
η	0.0001807	Pa×s	589.32	Joback Calculated Property
η	0.0001114	Pa×s	651.14	Joback Calculated Property
η	0.0000747	Pa×s	712.97	Joback Calculated Property
η	0.0000534	Pa×s	774.80	Joback Calculated Property
η	0.0000401	Pa×s	836.62	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, trans-hex-3-enyl undecyl 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.