Chemical Properties of Benzamide, 2-bromo-N-(2-bromobenzoyl)-N-(2-ethylhexyl)-

InChI

InChI=1S/C22H25Br2NO2/c1-3-5-10-16(4-2)15-25(21(26)17-11-6-8-13-19(17)23)22(27)18-12-7-9-14-20(18)24/h6-9,11-14,16H,3-5,10,15H2,1-2H3

InChI Key

HWMZHVJSKNSDJH-UHFFFAOYSA-N

Formula

C22H25Br2NO2

SMILES

CCCCC(CC)CN(C(=O)c1ccccc1Br)C(=O)c1ccccc1Br

Molecular Weight¹

495.25

• 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°	219.06	kJ/mol	Joback Calculated Property
ΔfH°gas	-157.54	kJ/mol	Joback Calculated Property
ΔfusH°	53.31	kJ/mol	Joback Calculated Property
ΔvapH°	98.46	kJ/mol	Joback Calculated Property
log10WS	-8.60		Crippen Calculated Property
logPoct/wat	6.711		Crippen Calculated Property
McVol	321.440	ml/mol	McGowan Calculated Property
Pc	1696.30	kPa	Joback Calculated Property
Inp	[3005.00; 3005.00]
Inp	3005.00		NIST
Inp	3005.00		NIST
Tboil	1018.14	K	Joback Calculated Property
Tc	1262.28	K	Joback Calculated Property
Tfus	652.51	K	Joback Calculated Property
Vc	1.200	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[951.99; 1019.83]	J/mol×K	[1018.14; 1262.28]
Cp,gas	951.99	J/mol×K	1018.14	Joback Calculated Property
Cp,gas	964.88	J/mol×K	1058.83	Joback Calculated Property
Cp,gas	976.95	J/mol×K	1099.52	Joback Calculated Property
Cp,gas	988.35	J/mol×K	1140.21	Joback Calculated Property
Cp,gas	999.20	J/mol×K	1180.90	Joback Calculated Property
Cp,gas	1009.65	J/mol×K	1221.59	Joback Calculated Property
Cp,gas	1019.83	J/mol×K	1262.28	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 2-bromo-N-(2-bromobenzoyl)-N-(2-ethylhexyl)-.

Sources

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

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