Chemical Properties of Sebacic acid, heptadecyl 2-methoxyethyl ester

InChI

InChI=1S/C30H58O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-20-23-26-34-29(31)24-21-18-15-16-19-22-25-30(32)35-28-27-33-2/h3-28H2,1-2H3

InChI Key

BPVTUZXGILRDKV-UHFFFAOYSA-N

Formula

C30H58O5

SMILES

CCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCC(=O)OCCOC

Molecular Weight¹

498.78

• 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

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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[689.97; 1601.78]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			5.19360e+01
Coefficient B			2.68104e+00
Coefficient C			-1.30800e-03
Coefficient D			1.76800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	689.97	J/mol×K	273.00	Calculated Property
Cp,gas	844.55	J/mol×K	353.78	Calculated Property
Cp,gas	984.50	J/mol×K	434.56	Calculated Property
Cp,gas	1110.40	J/mol×K	515.33	Calculated Property
Cp,gas	1222.79	J/mol×K	596.11	Calculated Property
Cp,gas	1322.24	J/mol×K	676.89	Calculated Property
Cp,gas	1409.30	J/mol×K	757.67	Calculated Property
Cp,gas	1484.54	J/mol×K	838.44	Calculated Property
Cp,gas	1548.51	J/mol×K	919.22	Calculated Property
Cp,gas	1601.78	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0002315; 0.0000106]	Pa×s	[534.75; 903.21]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.59198e+01
Coefficient B			4.03677e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			534.75
Temperature range, max.			903.21
η	0.0002315	Pa×s	534.75	Calculated Property
η	0.0001353	Pa×s	575.69	Calculated Property
η	0.0000850	Pa×s	616.63	Calculated Property
η	0.0000565	Pa×s	657.57	Calculated Property
η	0.0000394	Pa×s	698.51	Calculated Property
η	0.0000286	Pa×s	739.45	Calculated Property
η	0.0000215	Pa×s	780.39	Calculated Property
η	0.0000166	Pa×s	821.33	Calculated Property
η	0.0000132	Pa×s	862.27	Calculated Property
η	0.0000106	Pa×s	903.21	Calculated Property

Similar Compounds

Find more compounds similar to Sebacic acid, heptadecyl 2-methoxyethyl ester.

Sources

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

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