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

InChI

InChI=1S/C19H19Br2NO2/c1-2-3-8-13-22(18(23)14-9-4-6-11-16(14)20)19(24)15-10-5-7-12-17(15)21/h4-7,9-12H,2-3,8,13H2,1H3

InChI Key

PBJUOSSJIPUYDJ-UHFFFAOYSA-N

Formula

C19H19Br2NO2

SMILES

CCCCCN(C(=O)c1ccccc1Br)C(=O)c1ccccc1Br

Molecular Weight¹

453.17

• 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°	196.24	kJ/mol	Joback Calculated Property
ΔfH°gas	-90.34	kJ/mol	Joback Calculated Property
ΔfusH°	49.06	kJ/mol	Joback Calculated Property
ΔvapH°	92.17	kJ/mol	Joback Calculated Property
log10WS	-7.58		Crippen Calculated Property
logPoct/wat	5.684		Crippen Calculated Property
McVol	279.170	ml/mol	McGowan Calculated Property
Pc	2167.36	kPa	Joback Calculated Property
Inp	[2813.00; 2813.00]
Inp	2813.00		NIST
Inp	2813.00		NIST
Tboil	949.94	K	Joback Calculated Property
Tc	1196.16	K	Joback Calculated Property
Tfus	633.70	K	Joback Calculated Property
Vc	1.038	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[776.22; 837.42]	J/mol×K	[949.94; 1196.16]
Cp,gas	776.22	J/mol×K	949.94	Joback Calculated Property
Cp,gas	788.13	J/mol×K	990.98	Joback Calculated Property
Cp,gas	799.19	J/mol×K	1032.01	Joback Calculated Property
Cp,gas	809.53	J/mol×K	1073.05	Joback Calculated Property
Cp,gas	819.26	J/mol×K	1114.09	Joback Calculated Property
Cp,gas	828.52	J/mol×K	1155.13	Joback Calculated Property
Cp,gas	837.42	J/mol×K	1196.16	Joback Calculated Property

Similar Compounds

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

Sources

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

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