Chemical Properties of L-Leucine, N-methyl-N-propoxycarbonyl-, propyl ester

InChI

InChI=1S/C14H27NO4/c1-6-8-18-13(16)12(10-11(3)4)15(5)14(17)19-9-7-2/h11-12H,6-10H2,1-5H3

InChI Key

HLLRREYNPZXPJV-UHFFFAOYSA-N

Formula

C14H27NO4

SMILES

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

Molecular Weight¹

273.37

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• 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
ΔfusH°	33.56	kJ/mol	Joback Calculated Property
ΔvapH°	76.71	kJ/mol	Relay (1.0) Calculated Property
logPoct/wat	2.833		Crippen Calculated Property
McVol	232.980	ml/mol	McGowan Calculated Property
Pc	1657.84	kPa	Joback Calculated Property
Inp	[1645.00; 1645.00]
Inp	1645.00		NIST
Inp	1645.00		NIST
Tboil	564.91	K	Relay (1.0) Calculated Property
Tc	721.64	K	Relay (1.0) Calculated Property
Tfus	237.94	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Enthalpy of formation 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	[663.21; 749.25]	J/mol×K	[683.86; 863.70]
Cp,gas	663.21	J/mol×K	683.86	Joback Calculated Property
Cp,gas	679.58	J/mol×K	713.83	Joback Calculated Property
Cp,gas	695.13	J/mol×K	743.81	Joback Calculated Property
Cp,gas	709.86	J/mol×K	773.78	Joback Calculated Property
Cp,gas	723.78	J/mol×K	803.75	Joback Calculated Property
Cp,gas	736.90	J/mol×K	833.73	Joback Calculated Property
Cp,gas	749.25	J/mol×K	863.70	Joback Calculated Property

Similar Compounds

Find more compounds similar to L-Leucine, N-methyl-N-propoxycarbonyl-, propyl 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.