Chemical Properties of 1-Methyl-2-methoxyethyl heneicosanoate

InChI

InChI=1S/C25H50O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25(26)28-24(2)23-27-3/h24H,4-23H2,1-3H3

InChI Key

YKFVOYHLOSXGTM-UHFFFAOYSA-N

Formula

C25H50O3

SMILES

CCCCCCCCCCCCCCCCCCCCC(=O)OC(C)COC

Molecular Weight¹

398.66

• 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

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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[567.25; 1336.25]	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			2.93900e+01
Coefficient B			2.26676e+00
Coefficient C			-1.13380e-03
Coefficient D			1.73900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	567.25	J/mol×K	273.00	Calculated Property
Cp,gas	697.11	J/mol×K	353.78	Calculated Property
Cp,gas	814.59	J/mol×K	434.56	Calculated Property
Cp,gas	920.22	J/mol×K	515.33	Calculated Property
Cp,gas	1014.57	J/mol×K	596.11	Calculated Property
Cp,gas	1098.18	J/mol×K	676.89	Calculated Property
Cp,gas	1171.61	J/mol×K	757.67	Calculated Property
Cp,gas	1235.39	J/mol×K	838.44	Calculated Property
Cp,gas	1290.09	J/mol×K	919.22	Calculated Property
Cp,gas	1336.25	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0010253; 0.0000405]	Pa×s	[421.07; 730.32]	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			-1.45159e+01
Coefficient B			3.21407e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			421.07
Temperature range, max.			730.32
η	0.0010253	Pa×s	421.07	Calculated Property
η	0.0005764	Pa×s	455.43	Calculated Property
η	0.0003513	Pa×s	489.79	Calculated Property
η	0.0002285	Pa×s	524.15	Calculated Property
η	0.0001567	Pa×s	558.51	Calculated Property
η	0.0001123	Pa×s	592.87	Calculated Property
η	0.0000834	Pa×s	627.23	Calculated Property
η	0.0000639	Pa×s	661.59	Calculated Property
η	0.0000503	Pa×s	695.96	Calculated Property
η	0.0000405	Pa×s	730.32	Calculated Property

Similar Compounds

Find more compounds similar to 1-Methyl-2-methoxyethyl heneicosanoate.

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.
These property values are available through the Cheméo API. A free account gives you an access key.