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

InChI

InChI=1S/C17H11F6NO4/c1-24(16(25)6-4-8(18)12(22)14(27-2)10(6)20)17(26)7-5-9(19)13(23)15(28-3)11(7)21/h4-5H,1-3H3

InChI Key

ZNIIGQJNXPNTLN-UHFFFAOYSA-N

Formula

C17H11F6NO4

SMILES

COc1c(F)c(F)cc(C(=O)N(C)C(=O)c2cc(F)c(F)c(OC)c2F)c1F

Molecular Weight¹

407.26

• 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	0.8841		Relay (... Calculated Property
ΔfG°	-1285.88	kJ/mol	Joback Calculated Property
ΔfH°gas	-1376.54	kJ/mol	Relay (... Calculated Property
ΔfusH°	51.83	kJ/mol	Joback Calculated Property
ΔvapH°	94.19	kJ/mol	Relay (... Calculated Property
IE	8.95	eV	Relay (... Calculated Property
log10WS	-5.61		Relay (... Calculated Property
logPoct/wat	3.451		Crippen Calculated Property
McVol	238.350	ml/mol	McGowan Calculated Property
Pc	1615.47	kPa	Joback Calculated Property
Inp	[2053.00; 2053.00]
Inp	2053.00		NIST
Inp	2053.00		NIST
Tboil	622.34	K	Relay (... Calculated Property
Tc	884.14	K	Relay (... Calculated Property
Tfus	418.88	K	Relay (... Calculated Property
Vc	0.899	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[688.74; 737.91]	J/mol×K	[842.20; 1040.89]
Cp,gas	688.74	J/mol×K	842.20	Joback Calculated Property
Cp,gas	699.22	J/mol×K	875.32	Joback Calculated Property
Cp,gas	708.79	J/mol×K	908.43	Joback Calculated Property
Cp,gas	717.44	J/mol×K	941.55	Joback Calculated Property
Cp,gas	725.19	J/mol×K	974.66	Joback Calculated Property
Cp,gas	732.01	J/mol×K	1007.78	Joback Calculated Property
Cp,gas	737.91	J/mol×K	1040.89	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-methyl-.

Sources

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

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