Chemical Properties of Glycine, N-methyl-N-methoxycarbonyl-, isohexyl ester

InChI

InChI=1S/C11H21NO4/c1-9(2)6-5-7-16-10(13)8-12(3)11(14)15-4/h9H,5-8H2,1-4H3

InChI Key

ZQJJJKGHHWXLOC-UHFFFAOYSA-N

Formula

C11H21NO4

SMILES

COC(=O)N(C)CC(=O)OCCCC(C)C

Molecular Weight¹

231.29

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• 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_c : Critical Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	32.48	kJ/mol	Joback Calculated Property
logPoct/wat	1.664		Crippen Calculated Property
McVol	190.710	ml/mol	McGowan Calculated Property
Inp	[1529.00; 1529.00]
Inp	1529.00		NIST
Inp	1529.00		NIST
Tboil	542.71	K	Relay (1.0) Calculated Property
Tc	719.83	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, 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, 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[490.92; 570.99]	J/mol×K	[579.72; 754.88]
Cp,gas	490.92	J/mol×K	579.72	Joback Calculated Property
Cp,gas	506.05	J/mol×K	608.91	Joback Calculated Property
Cp,gas	520.46	J/mol×K	638.11	Joback Calculated Property
Cp,gas	534.15	J/mol×K	667.30	Joback Calculated Property
Cp,gas	547.13	J/mol×K	696.49	Joback Calculated Property
Cp,gas	559.41	J/mol×K	725.68	Joback Calculated Property
Cp,gas	570.99	J/mol×K	754.88	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glycine, N-methyl-N-methoxycarbonyl-, isohexyl 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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