Chemical Properties of Amineptine (CAS 57574-09-1)

InChI

InChI=1S/C22H27NO2/c24-21(25)13-3-1-2-8-16-23-22-19-11-6-4-9-17(19)14-15-18-10-5-7-12-20(18)22/h4-7,9-12,22-23H,1-3,8,13-16H2,(H,24,25)

InChI Key

ONNOFKFOZAJDHT-UHFFFAOYSA-N

Formula

C22H27NO2

SMILES

O=C(O)CCCCCCNC1c2ccccc2CCc2ccccc21

Molecular Weight¹

337.46

CAS

57574-09-1

• 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°	224.32	kJ/mol	Joback Calculated Property
ΔfH°gas	-185.83	kJ/mol	Joback Calculated Property
ΔfusH°	48.96	kJ/mol	Joback Calculated Property
ΔvapH°	100.22	kJ/mol	Joback Calculated Property
log10WS	-5.91		Crippen Calculated Property
logPoct/wat	4.499		Crippen Calculated Property
McVol	279.880	ml/mol	McGowan Calculated Property
Pc	1736.11	kPa	Joback Calculated Property
Inp	[3085.00; 3085.00]
Inp	3085.00		NIST
Inp	3085.00		NIST
Tboil	969.04	K	Joback Calculated Property
Tc	1194.06	K	Joback Calculated Property
Tfus	596.93	K	Joback Calculated Property
Vc	1.069	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[923.66; 999.55]	J/mol×K	[969.04; 1194.06]
Cp,gas	923.66	J/mol×K	969.04	Joback Calculated Property
Cp,gas	937.95	J/mol×K	1006.54	Joback Calculated Property
Cp,gas	951.43	J/mol×K	1044.05	Joback Calculated Property
Cp,gas	964.21	J/mol×K	1081.55	Joback Calculated Property
Cp,gas	976.42	J/mol×K	1119.05	Joback Calculated Property
Cp,gas	988.16	J/mol×K	1156.56	Joback Calculated Property
Cp,gas	999.55	J/mol×K	1194.06	Joback Calculated Property

Similar Compounds

Find more compounds similar to Amineptine.

Sources

• 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.