Chemical Properties of Benzamide, 2,4,5-trifluoro-3-methoxy-N-(2,4,5-trifluoro-3-methoxybenzoyl)-N-butyl-

InChI

InChI=1S/C20H17F6NO4/c1-4-5-6-27(19(28)9-7-11(21)15(25)17(30-2)13(9)23)20(29)10-8-12(22)16(26)18(31-3)14(10)24/h7-8H,4-6H2,1-3H3

InChI Key

VSXNQEZPMBQUIC-UHFFFAOYSA-N

Formula

C20H17F6NO4

SMILES

CCCCN(C(=O)c1cc(F)c(F)c(OC)c1F)C(=O)c1cc(F)c(F)c(OC)c1F

Molecular Weight¹

449.34

• 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°	-1260.62	kJ/mol	Joback Calculated Property
ΔfH°gas	-1673.56	kJ/mol	Joback Calculated Property
ΔfusH°	59.60	kJ/mol	Joback Calculated Property
ΔvapH°	85.42	kJ/mol	Joback Calculated Property
log10WS	-7.07		Crippen Calculated Property
logPoct/wat	4.621		Crippen Calculated Property
McVol	280.620	ml/mol	McGowan Calculated Property
Pc	1297.66	kPa	Joback Calculated Property
Inp	[2231.00; 2231.00]
Inp	2231.00		NIST
Inp	2231.00		NIST
Tboil	910.84	K	Joback Calculated Property
Tc	1116.44	K	Joback Calculated Property
Tfus	648.49	K	Joback Calculated Property
Vc	1.113	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[857.89; 909.62]	J/mol×K	[910.84; 1116.44]
Cp,gas	857.89	J/mol×K	910.84	Joback Calculated Property
Cp,gas	869.31	J/mol×K	945.11	Joback Calculated Property
Cp,gas	879.61	J/mol×K	979.37	Joback Calculated Property
Cp,gas	888.78	J/mol×K	1013.64	Joback Calculated Property
Cp,gas	896.84	J/mol×K	1047.90	Joback Calculated Property
Cp,gas	903.78	J/mol×K	1082.17	Joback Calculated Property
Cp,gas	909.62	J/mol×K	1116.44	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 2,4,5-trifluoro-3-methoxy-N-(2,4,5-trifluoro-3-methoxybenzoyl)-N-butyl-.

Sources

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

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