Chemical Properties of Leu, isopropyl ester

InChI

InChI=1S/C9H19NO2/c1-6(2)5-8(10)9(11)12-7(3)4/h6-8H,5,10H2,1-4H3

InChI Key

KDESEECZHLTGMH-UHFFFAOYSA-N

Formula

C9H19NO2

SMILES

CC(C)CC(N)C(=O)OC(C)C

Molecular Weight¹

173.25

• 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°	-149.89	kJ/mol	Joback Calculated Property
ΔfH°gas	-455.94	kJ/mol	Joback Calculated Property
ΔfusH°	16.48	kJ/mol	Joback Calculated Property
ΔvapH°	54.26	kJ/mol	Joback Calculated Property
log10WS	-1.87		Crippen Calculated Property
logPoct/wat	1.311		Crippen Calculated Property
McVol	155.090	ml/mol	McGowan Calculated Property
Pc	2616.41	kPa	Joback Calculated Property
Inp	[1212.00; 1220.00]
Inp	1220.00		NIST
Inp	1217.00		NIST
Inp	1212.00		NIST
Inp	1212.00		NIST
Tboil	552.82	K	Joback Calculated Property
Tc	748.04	K	Joback Calculated Property
Tfus	301.61	K	Joback Calculated Property
Vc	0.575	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[385.51; 462.48]	J/mol×K	[552.82; 748.04]
Cp,gas	385.51	J/mol×K	552.82	Joback Calculated Property
Cp,gas	399.99	J/mol×K	585.36	Joback Calculated Property
Cp,gas	413.79	J/mol×K	617.89	Joback Calculated Property
Cp,gas	426.93	J/mol×K	650.43	Joback Calculated Property
Cp,gas	439.42	J/mol×K	682.97	Joback Calculated Property
Cp,gas	451.27	J/mol×K	715.51	Joback Calculated Property
Cp,gas	462.48	J/mol×K	748.04	Joback Calculated Property

Similar Compounds

Find more compounds similar to Leu, isopropyl ester.

Sources

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

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