Chemical Properties of Glycine, N-methyl-n-propoxycarbonyl-, isobutyl ester

InChI

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

InChI Key

DXXCMXSQTVQWQM-UHFFFAOYSA-N

Formula

C11H21NO4

SMILES

CCCOC(=O)N(C)CC(=O)OCC(C)C

Molecular Weight¹

231.29

• 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	0.7173		Relay (1.0) Calculated Property
ΔfG°	-317.76	kJ/mol	Joback Calculated Property
ΔfH°gas	-863.57	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	29.32	kJ/mol	Joback Calculated Property
ΔvapH°	71.36	kJ/mol	Relay (1.0) Calculated Property
IE	9.08	eV	Relay (1.0) Calculated Property
log10WS	-1.64		Relay (1.0) Calculated Property
logPoct/wat	1.664		Crippen Calculated Property
McVol	190.710	ml/mol	McGowan Calculated Property
Pc	2111.94	kPa	Joback Calculated Property
Inp	[1467.00; 1467.00]
Inp	1467.00		NIST
Inp	1467.00		NIST
Tboil	545.84	K	Relay (1.0) Calculated Property
Tc	703.79	K	Relay (1.0) Calculated Property
Tfus	246.15	K	Relay (1.0) Calculated Property
Vc	0.731	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[502.99; 580.67]	J/mol×K	[615.66; 795.73]
Cp,gas	502.99	J/mol×K	615.66	Joback Calculated Property
Cp,gas	517.61	J/mol×K	645.67	Joback Calculated Property
Cp,gas	531.55	J/mol×K	675.68	Joback Calculated Property
Cp,gas	544.83	J/mol×K	705.69	Joback Calculated Property
Cp,gas	557.43	J/mol×K	735.70	Joback Calculated Property
Cp,gas	569.38	J/mol×K	765.72	Joback Calculated Property
Cp,gas	580.67	J/mol×K	795.73	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glycine, N-methyl-n-propoxycarbonyl-, isobutyl ester.

Sources

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

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