Chemical Properties of l-Leucine, N-allyloxycarbonyl-N-methyl-, propyl ester

InChI

InChI=1S/C14H25NO4/c1-6-8-18-13(16)12(10-11(3)4)15(5)14(17)19-9-7-2/h7,11-12H,2,6,8-10H2,1,3-5H3

InChI Key

LIFVPMZSQXEDOD-UHFFFAOYSA-N

Formula

C14H25NO4

SMILES

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

Molecular Weight¹

271.35

• 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).
• 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
ΔfG°	-207.10	kJ/mol	Joback Calculated Property
ΔfH°gas	-639.49	kJ/mol	Joback Calculated Property
ΔfusH°	32.28	kJ/mol	Joback Calculated Property
ΔvapH°	65.67	kJ/mol	Joback Calculated Property
log10WS	-2.68		Crippen Calculated Property
logPoct/wat	2.609		Crippen Calculated Property
McVol	228.680	ml/mol	McGowan Calculated Property
Pc	1716.03	kPa	Joback Calculated Property
Inp	[1645.00; 1645.00]
Inp	1645.00		NIST
Inp	1645.00		NIST
Tboil	680.54	K	Joback Calculated Property
Tc	862.63	K	Joback Calculated Property
Tfus	392.57	K	Joback Calculated Property
Vc	0.855	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[639.61; 722.68]	J/mol×K	[680.54; 862.63]
Cp,gas	639.61	J/mol×K	680.54	Joback Calculated Property
Cp,gas	655.47	J/mol×K	710.89	Joback Calculated Property
Cp,gas	670.50	J/mol×K	741.24	Joback Calculated Property
Cp,gas	684.73	J/mol×K	771.58	Joback Calculated Property
Cp,gas	698.16	J/mol×K	801.93	Joback Calculated Property
Cp,gas	710.80	J/mol×K	832.28	Joback Calculated Property
Cp,gas	722.68	J/mol×K	862.63	Joback Calculated Property

Similar Compounds

Find more compounds similar to l-Leucine, N-allyloxycarbonyl-N-methyl-, propyl ester.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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