Chemical Properties of 2-Methoxyethyl cyanoacetate

InChI

InChI=1S/C6H9NO3/c1-9-4-5-10-6(8)2-3-7/h2,4-5H2,1H3

InChI Key

SGLKIEOMYXTGBH-UHFFFAOYSA-N

Formula

C6H9NO3

SMILES

COCCOC(=O)CC#N

Molecular Weight¹

143.14

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• 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 Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l 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	[165.88; 331.96]	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			6.53430e+01
Coefficient B			3.90620e-01
Coefficient C			-6.60000e-05
Coefficient D			-5.80000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	165.88	J/mol×K	273.00	Calculated Property
Cp,gas	192.71	J/mol×K	353.78	Calculated Property
Cp,gas	217.87	J/mol×K	434.56	Calculated Property
Cp,gas	241.18	J/mol×K	515.33	Calculated Property
Cp,gas	262.46	J/mol×K	596.11	Calculated Property
Cp,gas	281.52	J/mol×K	676.89	Calculated Property
Cp,gas	298.19	J/mol×K	757.67	Calculated Property
Cp,gas	312.27	J/mol×K	838.44	Calculated Property
Cp,gas	323.59	J/mol×K	919.22	Calculated Property
Cp,gas	331.96	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 2-Methoxyethyl cyanoacetate.

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.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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