Chemical Properties of Glycine, N-methyl-N-allyloxycarbonyl-, octyl ester

InChI

InChI=1S/C15H27NO4/c1-4-6-7-8-9-10-12-19-14(17)13-16(3)15(18)20-11-5-2/h5H,2,4,6-13H2,1,3H3

InChI Key

ZMEBVGWCUAPVDG-UHFFFAOYSA-N

Formula

C15H27NO4

SMILES

C=CCOC(=O)N(C)CC(=O)OCCCCCCCC

Molecular Weight¹

285.38

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.8511		Relay (1.0) Calculated Property
ΔfG°	-193.80	kJ/mol	Joback Calculated Property
ΔfH°gas	-808.92	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	41.92	kJ/mol	Joback Calculated Property
ΔvapH°	88.37	kJ/mol	Relay (1.0) Calculated Property
IE	9.03	eV	Relay (1.0) Calculated Property
log10WS	-3.27		Relay (1.0) Calculated Property
logPoct/wat	3.144		Crippen Calculated Property
McVol	242.770	ml/mol	McGowan Calculated Property
Pc	1567.23	kPa	Joback Calculated Property
Inp	[1836.00; 1836.00]
Inp	1836.00		NIST
Inp	1836.00		NIST
Tboil	601.26	K	Relay (1.0) Calculated Property
Tc	762.72	K	Relay (1.0) Calculated Property
Tfus	249.85	K	Relay (1.0) Calculated Property
Vc	0.904	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[693.82; 776.99]	J/mol×K	[704.30; 881.49]
Cp,gas	693.82	J/mol×K	704.30	Joback Calculated Property
Cp,gas	709.64	J/mol×K	733.83	Joback Calculated Property
Cp,gas	724.66	J/mol×K	763.36	Joback Calculated Property
Cp,gas	738.89	J/mol×K	792.90	Joback Calculated Property
Cp,gas	752.34	J/mol×K	822.43	Joback Calculated Property
Cp,gas	765.04	J/mol×K	851.96	Joback Calculated Property
Cp,gas	776.99	J/mol×K	881.49	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glycine, N-methyl-N-allyloxycarbonyl-, octyl ester.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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