Chemical Properties of Tridecyl decanoate

InChI

InChI=1S/C23H46O2/c1-3-5-7-9-11-12-13-14-16-18-20-22-25-23(24)21-19-17-15-10-8-6-4-2/h3-22H2,1-2H3

InChI Key

JFOWPZXGNKSOTH-UHFFFAOYSA-N

Formula

C23H46O2

SMILES

CCCCCCCCCCCCCOC(=O)CCCCCCCCC

Molecular Weight¹

354.62

• ω : Acentric Factor.
• 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).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	1.0808		Relay (1.0) Calculated Property
ΔfH°gas	-833.71	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	58.11	kJ/mol	Joback Calculated Property
ΔvapH°	109.53	kJ/mol	Relay (1.0) Calculated Property
IE	9.75	eV	Relay (1.0) Calculated Property
log10WS	-7.75		Relay (1.0) Calculated Property
logPoct/wat	7.981		Crippen Calculated Property
McVol	342.370	ml/mol	McGowan Calculated Property
Pc	875.32	kPa	Joback Calculated Property
Inp	[2477.90; 2477.90]
Inp	2477.90		NIST
Inp	2477.90		NIST
Tboil	613.27	K	Relay (1.0) Calculated Property
Tc	797.15	K	Relay (1.0) Calculated Property
Tfus	302.21	K	Relay (1.0) Calculated Property
Vc	1.350	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1093.53; 1204.49]	J/mol×K	[801.93; 982.34]
Cp,gas	1093.53	J/mol×K	801.93	Joback Calculated Property
Cp,gas	1114.64	J/mol×K	832.00	Joback Calculated Property
Cp,gas	1134.65	J/mol×K	862.07	Joback Calculated Property
Cp,gas	1153.61	J/mol×K	892.14	Joback Calculated Property
Cp,gas	1171.55	J/mol×K	922.21	Joback Calculated Property
Cp,gas	1188.50	J/mol×K	952.27	Joback Calculated Property
Cp,gas	1204.49	J/mol×K	982.34	Joback Calculated Property
η	[0.0000483; 0.0011936]	Pa×s	[421.13; 801.93]
η	0.0011936	Pa×s	421.13	Joback Calculated Property
η	0.0004928	Pa×s	484.60	Joback Calculated Property
η	0.0002498	Pa×s	548.06	Joback Calculated Property
η	0.0001457	Pa×s	611.53	Joback Calculated Property
η	0.0000941	Pa×s	675.00	Joback Calculated Property
η	0.0000655	Pa×s	738.46	Joback Calculated Property
η	0.0000483	Pa×s	801.93	Joback Calculated Property

Similar Compounds

Find more compounds similar to Tridecyl decanoate.

Sources

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

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