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

InChI

InChI=1S/C27H29F8NO2/c1-2-3-4-5-6-7-8-9-10-17-36(24(37)18-13-11-15-20(22(18)28)26(30,31)32)25(38)19-14-12-16-21(23(19)29)27(33,34)35/h11-16H,2-10,17H2,1H3

InChI Key

UPIBEEFQCAUNOI-UHFFFAOYSA-N

Formula

C27H29F8NO2

SMILES

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

Molecular Weight¹

551.51

• 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°	-1337.10	kJ/mol	Joback Calculated Property
ΔfH°gas	-1917.44	kJ/mol	Joback Calculated Property
ΔfusH°	68.24	kJ/mol	Joback Calculated Property
ΔvapH°	89.30	kJ/mol	Joback Calculated Property
log10WS	-10.64		Crippen Calculated Property
logPoct/wat	8.816		Crippen Calculated Property
McVol	371.050	ml/mol	McGowan Calculated Property
Pc	862.01	kPa	Joback Calculated Property
Inp	[2628.00; 2628.00]
Inp	2628.00		NIST
Inp	2628.00		NIST
Tboil	998.32	K	Joback Calculated Property
Tc	1226.08	K	Joback Calculated Property
Tfus	638.86	K	Joback Calculated Property
Vc	1.484	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1237.94; 1318.80]	J/mol×K	[998.32; 1226.08]
Cp,gas	1237.94	J/mol×K	998.32	Joback Calculated Property
Cp,gas	1253.28	J/mol×K	1036.28	Joback Calculated Property
Cp,gas	1267.67	J/mol×K	1074.24	Joback Calculated Property
Cp,gas	1281.26	J/mol×K	1112.20	Joback Calculated Property
Cp,gas	1294.21	J/mol×K	1150.16	Joback Calculated Property
Cp,gas	1306.67	J/mol×K	1188.12	Joback Calculated Property
Cp,gas	1318.80	J/mol×K	1226.08	Joback Calculated Property

Similar Compounds

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

Sources

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

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