Chemical Properties of Methoxyacetic acid, 10-undecenyl ester

InChI

InChI=1S/C14H26O3/c1-3-4-5-6-7-8-9-10-11-12-17-14(15)13-16-2/h3H,1,4-13H2,2H3

InChI Key

XLSYXPCIXRAHMB-UHFFFAOYSA-N

Formula

C14H26O3

SMILES

C=CCCCCCCCCCOC(=O)COC

Molecular Weight¹

242.36

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion 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).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	36.29	kJ/mol	Joback Calculated Property
log10WS	-3.73		Relay (1.0) Calculated Property
logPoct/wat	3.483		Crippen Calculated Property
McVol	217.130	ml/mol	McGowan Calculated Property
Inp	[1646.00; 1646.00]
Inp	1646.00		NIST
Inp	1646.00		NIST
Tboil	567.94	K	Relay (1.0) Calculated Property
Tfus	267.16	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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	[324.41; 739.70]	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			3.80800e+01
Coefficient B			1.19582e+00
Coefficient C			-5.55100e-04
Coefficient D			6.09000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	324.41	J/mol×K	273.00	Calculated Property
Cp,gas	394.36	J/mol×K	353.78	Calculated Property
Cp,gas	457.90	J/mol×K	434.56	Calculated Property
Cp,gas	515.24	J/mol×K	515.33	Calculated Property
Cp,gas	566.57	J/mol×K	596.11	Calculated Property
Cp,gas	612.07	J/mol×K	676.89	Calculated Property
Cp,gas	651.94	J/mol×K	757.67	Calculated Property
Cp,gas	686.37	J/mol×K	838.44	Calculated Property
Cp,gas	715.56	J/mol×K	919.22	Calculated Property
Cp,gas	739.70	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0028333; 0.0001702]	Pa×s	[310.34; 535.58]	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			-1.25536e+01
Coefficient B			2.07533e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			310.34
Temperature range, max.			535.58
η	0.0028333	Pa×s	310.34	Calculated Property
η	0.0017202	Pa×s	335.37	Calculated Property
η	0.0011193	Pa×s	360.39	Calculated Property
η	0.0007701	Pa×s	385.42	Calculated Property
η	0.0005546	Pa×s	410.45	Calculated Property
η	0.0004147	Pa×s	435.47	Calculated Property
η	0.0003201	Pa×s	460.50	Calculated Property
η	0.0002537	Pa×s	485.53	Calculated Property
η	0.0002058	Pa×s	510.55	Calculated Property
η	0.0001702	Pa×s	535.58	Calculated Property

Similar Compounds

Find more compounds similar to Methoxyacetic acid, 10-undecenyl ester.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• 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.
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