Chemical Properties of Benzamide, 2,4,5-trifluoro-3-methoxy-N-octadecyl-

InChI

InChI=1S/C26H42F3NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-30-26(31)21-20-22(27)24(29)25(32-2)23(21)28/h20H,3-19H2,1-2H3,(H,30,31)

InChI Key

KCOIZMLQGOKABR-UHFFFAOYSA-N

Formula

C26H42F3NO2

SMILES

CCCCCCCCCCCCCCCCCCNC(=O)c1cc(F)c(F)c(OC)c1F

Molecular Weight¹

457.61

• 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_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).
• 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
ω	1.2298		Relay (1.0) Calculated Property
ΔfG°	-487.03	kJ/mol	Joback Calculated Property
ΔfH°gas	-1085.36	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	72.71	kJ/mol	Joback Calculated Property
ΔvapH°	131.68	kJ/mol	Relay (1.0) Calculated Property
IE	9.14	eV	Relay (1.0) Calculated Property
log10WS	-8.52		Relay (1.0) Calculated Property
logPoct/wat	8.104		Crippen Calculated Property
McVol	376.170	ml/mol	McGowan Calculated Property
Pc	807.54	kPa	Joback Calculated Property
Inp	[3162.00; 3162.00]
Inp	3162.00		NIST
Inp	3162.00		NIST
Tboil	671.59	K	Relay (1.0) Calculated Property
Tc	897.76	K	Relay (1.0) Calculated Property
Tfus	369.24	K	Relay (1.0) Calculated Property
Vc	1.420	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1277.64; 1370.35]	J/mol×K	[965.15; 1187.63]
Cp,gas	1277.64	J/mol×K	965.15	Joback Calculated Property
Cp,gas	1296.73	J/mol×K	1002.23	Joback Calculated Property
Cp,gas	1314.29	J/mol×K	1039.31	Joback Calculated Property
Cp,gas	1330.38	J/mol×K	1076.39	Joback Calculated Property
Cp,gas	1345.04	J/mol×K	1113.47	Joback Calculated Property
Cp,gas	1358.35	J/mol×K	1150.55	Joback Calculated Property
Cp,gas	1370.35	J/mol×K	1187.63	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 2,4,5-trifluoro-3-methoxy-N-octadecyl-.

Sources

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

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