Chemical Properties of Benzamide, 3-trifluoromethyl-2-fluoro-N-(3-trifluoromethyl-2-fluorobenzoyl)-N-octadecyl-

InChI

InChI=1S/C34H43F8NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-43(31(44)25-20-18-22-27(29(25)35)33(37,38)39)32(45)26-21-19-23-28(30(26)36)34(40,41)42/h18-23H,2-17,24H2,1H3

InChI Key

VICDHFSUZXZTMB-UHFFFAOYSA-N

Formula

C34H43F8NO2

SMILES

CCCCCCCCCCCCCCCCCCN(C(=O)c1cccc(C(F)(F)F)c1F)C(=O)c1cccc(C(F)(F)F)c1F

Molecular Weight¹

649.70

• 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	1.4228		Relay (1.0) Calculated Property
ΔfG°	-1278.16	kJ/mol	Joback Calculated Property
ΔfH°gas	-2085.15	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	86.37	kJ/mol	Joback Calculated Property
ΔvapH°	143.67	kJ/mol	Relay (1.0) Calculated Property
IE	9.28	eV	Relay (1.0) Calculated Property
log10WS	-11.03		Relay (1.0) Calculated Property
logPoct/wat	11.546		Crippen Calculated Property
McVol	469.680	ml/mol	McGowan Calculated Property
Pc	601.32	kPa	Joback Calculated Property
Inp	[3336.00; 3336.00]
Inp	3336.00		NIST
Inp	3336.00		NIST
Tboil	758.40	K	Relay (1.0) Calculated Property
Tc	986.90	K	Relay (1.0) Calculated Property
Tfus	374.86	K	Relay (1.0) Calculated Property
Vc	1.767	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1679.45; 1816.08]	J/mol×K	[1158.48; 1478.94]
Cp,gas	1679.45	J/mol×K	1158.48	Joback Calculated Property
Cp,gas	1702.83	J/mol×K	1211.89	Joback Calculated Property
Cp,gas	1725.29	J/mol×K	1265.30	Joback Calculated Property
Cp,gas	1747.34	J/mol×K	1318.71	Joback Calculated Property
Cp,gas	1769.48	J/mol×K	1372.12	Joback Calculated Property
Cp,gas	1792.23	J/mol×K	1425.53	Joback Calculated Property
Cp,gas	1816.08	J/mol×K	1478.94	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 3-trifluoromethyl-2-fluoro-N-(3-trifluoromethyl-2-fluorobenzoyl)-N-octadecyl-.

Sources

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

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