Chemical Properties of APRINDINE, M (DESINDANE-), AC

InChI

InChI=1S/C16H25NO/c1-4-15(5-2)10-9-13-17(14(3)18)16-11-7-6-8-12-16/h6-8,11-12,15H,4-5,9-10,13H2,1-3H3

InChI Key

ZENIDPFCJVVWNQ-UHFFFAOYSA-N

Formula

C16H25NO

SMILES

CCC(CC)CCCN(C(C)=O)c1ccccc1

Molecular Weight¹

247.38

• 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°	175.67	kJ/mol	Joback Calculated Property
ΔfH°gas	-187.37	kJ/mol	Joback Calculated Property
ΔfusH°	32.33	kJ/mol	Joback Calculated Property
ΔvapH°	61.89	kJ/mol	Joback Calculated Property
log10WS	-4.26		Crippen Calculated Property
logPoct/wat	4.256		Crippen Calculated Property
McVol	224.090	ml/mol	McGowan Calculated Property
Pc	1804.63	kPa	Joback Calculated Property
Inp	[1880.00; 1880.00]
Inp	1880.00		NIST
Inp	1880.00		NIST
Tboil	658.03	K	Joback Calculated Property
Tc	855.92	K	Joback Calculated Property
Tfus	363.90	K	Joback Calculated Property
Vc	0.842	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[611.37; 704.94]	J/mol×K	[658.03; 855.92]
Cp,gas	611.37	J/mol×K	658.03	Joback Calculated Property
Cp,gas	629.48	J/mol×K	691.01	Joback Calculated Property
Cp,gas	646.51	J/mol×K	723.99	Joback Calculated Property
Cp,gas	662.53	J/mol×K	756.97	Joback Calculated Property
Cp,gas	677.57	J/mol×K	789.95	Joback Calculated Property
Cp,gas	691.69	J/mol×K	822.94	Joback Calculated Property
Cp,gas	704.94	J/mol×K	855.92	Joback Calculated Property

Similar Compounds

Find more compounds similar to APRINDINE, M (DESINDANE-), AC.

Sources

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

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