Chemical Properties of GALLOPAMIL, M(N-BIS-DESALKYL-), AC

InChI

InChI=1S/C19H28N2O4/c1-13(2)19(12-20,8-7-9-21-14(3)22)15-10-16(23-4)18(25-6)17(11-15)24-5/h10-11,13H,7-9H2,1-6H3,(H,21,22)

InChI Key

FDGIVHXEKCWGFY-UHFFFAOYSA-N

Formula

C19H28N2O4

SMILES

COc1cc(C(C#N)(CCCN=C(C)O)C(C)C)cc(OC)c1OC

Molecular Weight¹

348.44

• Δ_fH°_gas : Enthalpy of formation 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-558.98	kJ/mol	Joback Calculated Property
ΔvapH°	98.25	kJ/mol	Joback Calculated Property
log10WS	-4.26		Crippen Calculated Property
logPoct/wat	3.886		Crippen Calculated Property
McVol	285.350	ml/mol	McGowan Calculated Property
Pc	1263.75	kPa	Joback Calculated Property
Inp	[2500.00; 2500.00]
Inp	2500.00		NIST
Inp	2500.00		NIST
Tboil	1010.15	K	Joback Calculated Property
Tc	1238.38	K	Joback Calculated Property

Similar Compounds

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

Sources

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

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