Chemical Properties of Benzamide, 3-chloro-N-(3-chlorobenzoyl)-N-octyl-

InChI

InChI=1S/C22H25Cl2NO2/c1-2-3-4-5-6-7-14-25(21(26)17-10-8-12-19(23)15-17)22(27)18-11-9-13-20(24)16-18/h8-13,15-16H,2-7,14H2,1H3

InChI Key

JSRIWRCRFJSFPY-UHFFFAOYSA-N

Formula

C22H25Cl2NO2

SMILES

CCCCCCCCN(C(=O)c1cccc(Cl)c1)C(=O)c1cccc(Cl)c1

Molecular Weight¹

406.35

• 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°	169.00	kJ/mol	Joback Calculated Property
ΔfH°gas	-236.40	kJ/mol	Joback Calculated Property
ΔfusH°	54.65	kJ/mol	Joback Calculated Property
ΔvapH°	94.75	kJ/mol	Joback Calculated Property
log10WS	-7.88		Crippen Calculated Property
logPoct/wat	6.637		Crippen Calculated Property
McVol	310.920	ml/mol	McGowan Calculated Property
Pc	1426.15	kPa	Joback Calculated Property
Inp	[2847.00; 2847.00]
Inp	2847.00		NIST
Inp	2847.00		NIST
Tboil	961.12	K	Joback Calculated Property
Tc	1191.09	K	Joback Calculated Property
Tfus	607.75	K	Joback Calculated Property
Vc	1.179	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[930.38; 996.34]	J/mol×K	[961.12; 1191.09]
Cp,gas	930.38	J/mol×K	961.12	Joback Calculated Property
Cp,gas	943.62	J/mol×K	999.45	Joback Calculated Property
Cp,gas	955.84	J/mol×K	1037.78	Joback Calculated Property
Cp,gas	967.12	J/mol×K	1076.10	Joback Calculated Property
Cp,gas	977.56	J/mol×K	1114.43	Joback Calculated Property
Cp,gas	987.27	J/mol×K	1152.76	Joback Calculated Property
Cp,gas	996.34	J/mol×K	1191.09	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 3-chloro-N-(3-chlorobenzoyl)-N-octyl-.

Sources

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

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