Chemical Properties of DISOPYRAMIDE, M(N-DESALKYL-), AC

InChI

InChI=1S/C18H20N2O2/c1-14(21)20-13-12-18(17(19)22,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-11H,12-13H2,1H3,(H2,19,22)(H,20,21)

InChI Key

SUSVAGLOTXKSAV-UHFFFAOYSA-N

Formula

C18H20N2O2

SMILES

CC(=O)NCCC(C(N)=O)(c1ccccc1)c1ccccc1

Molecular Weight¹

296.36

• 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°	226.34	kJ/mol	Joback Calculated Property
ΔfH°gas	-88.44	kJ/mol	Joback Calculated Property
ΔfusH°	36.54	kJ/mol	Joback Calculated Property
ΔvapH°	89.49	kJ/mol	Joback Calculated Property
log10WS	-3.51		Crippen Calculated Property
logPoct/wat	1.984		Crippen Calculated Property
McVol	240.060	ml/mol	McGowan Calculated Property
Pc	2336.03	kPa	Joback Calculated Property
Inp	[2640.00; 2640.00]
Inp	2640.00		NIST
Inp	2640.00		NIST
Tboil	891.81	K	Joback Calculated Property
Tc	1138.77	K	Joback Calculated Property
Tfus	583.66	K	Joback Calculated Property
Vc	0.892	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[731.36; 795.79]	J/mol×K	[891.81; 1138.77]
Cp,gas	731.36	J/mol×K	891.81	Joback Calculated Property
Cp,gas	744.37	J/mol×K	932.97	Joback Calculated Property
Cp,gas	756.29	J/mol×K	974.13	Joback Calculated Property
Cp,gas	767.25	J/mol×K	1015.29	Joback Calculated Property
Cp,gas	777.40	J/mol×K	1056.45	Joback Calculated Property
Cp,gas	786.87	J/mol×K	1097.61	Joback Calculated Property
Cp,gas	795.79	J/mol×K	1138.77	Joback Calculated Property

Similar Compounds

Find more compounds similar to DISOPYRAMIDE, M(N-DESALKYL-), AC.

Sources

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

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