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

InChI

InChI=1S/C12H23NO4/c1-4-5-6-7-8-9-17-11(14)10-13(2)12(15)16-3/h4-10H2,1-3H3

InChI Key

VGVUAFYQYPTAOO-UHFFFAOYSA-N

Formula

C12H23NO4

SMILES

CCCCCCCOC(=O)CN(C)C(=O)OC

Molecular Weight¹

245.32

• 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).
• 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

Property	Value	Unit	Source
ΔfH°gas	-854.52	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	38.59	kJ/mol	Joback Calculated Property
ΔvapH°	83.02	kJ/mol	Relay (1.0) Calculated Property
log10WS	-2.40		Relay (1.0) Calculated Property
logPoct/wat	2.198		Crippen Calculated Property
McVol	204.800	ml/mol	McGowan Calculated Property
Pc	1792.42	kPa	Joback Calculated Property
Inp	[1639.00; 1639.00]
Inp	1639.00		NIST
Inp	1639.00		NIST
Tboil	555.71	K	Relay (1.0) Calculated Property
Tc	735.96	K	Relay (1.0) Calculated Property
Tfus	258.33	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[541.66; 623.11]	J/mol×K	[603.04; 774.26]
Cp,gas	541.66	J/mol×K	603.04	Joback Calculated Property
Cp,gas	557.03	J/mol×K	631.58	Joback Calculated Property
Cp,gas	571.68	J/mol×K	660.11	Joback Calculated Property
Cp,gas	585.60	J/mol×K	688.65	Joback Calculated Property
Cp,gas	598.81	J/mol×K	717.19	Joback Calculated Property
Cp,gas	611.31	J/mol×K	745.72	Joback Calculated Property
Cp,gas	623.11	J/mol×K	774.26	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glycine, N-methyl-N-methoxycarbonyl-, heptyl ester.

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.
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