Chemical Properties of N-Acetyl-D-leucine amide (CAS 16624-68-3)

InChI

InChI=1S/C8H16N2O2/c1-5(2)4-7(8(9)12)10-6(3)11/h5,7H,4H2,1-3H3,(H2,9,12)(H,10,11)/t7-/m1/s1

InChI Key

PHPXQAHAQREGGN-SSDOTTSWSA-N

Formula

C8H16N2O2

SMILES

CC(=O)NC(CC(C)C)C(N)=O

Molecular Weight¹

172.22

CAS

16624-68-3

• 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_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_subH° : Enthalpy of sublimation at standard conditions (kJ/mol).
• Δ_subH : Enthalpy of sublimation at a given temperature (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).
• Δ_fusS : Entropy of fusion at a given temperature (J/mol×K).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[380.07; 444.62]	J/mol×K	[612.00; 816.13]
Cp,gas	380.07	J/mol×K	612.00	Joback Calculated Property
Cp,gas	392.53	J/mol×K	646.02	Joback Calculated Property
Cp,gas	404.28	J/mol×K	680.04	Joback Calculated Property
Cp,gas	415.34	J/mol×K	714.06	Joback Calculated Property
Cp,gas	425.74	J/mol×K	748.09	Joback Calculated Property
Cp,gas	435.49	J/mol×K	782.11	Joback Calculated Property
Cp,gas	444.62	J/mol×K	816.13	Joback Calculated Property
ΔfusH	[20.20; 20.20]	kJ/mol	[404.00; 404.00]
ΔfusH	20.20	kJ/mol	404.00	NIST
ΔfusH	20.20	kJ/mol	404.00	NIST
ΔfusH	20.20	kJ/mol	404.00	NIST
ΔsubH	[101.00; 114.80]	kJ/mol	[387.50; 393.00]
ΔsubH	101.00 ± 3.00	kJ/mol	387.50	NIST
ΔsubH	114.80 ± 0.30	kJ/mol	393.00	NIST
ΔfusS	50.00	J/mol×K	404.00	NIST

Similar Compounds

Find more compounds similar to N-Acetyl-D-leucine amide.

Sources

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

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