Chemical Properties of 4-Chlorobenzamide, N-(4-chlorobenzoyl)-N-heptyl-

InChI

InChI=1S/C21H23Cl2NO2/c1-2-3-4-5-6-15-24(20(25)16-7-11-18(22)12-8-16)21(26)17-9-13-19(23)14-10-17/h7-14H,2-6,15H2,1H3

InChI Key

ITBFMBNWUCXTDP-UHFFFAOYSA-N

Formula

C21H23Cl2NO2

SMILES

CCCCCCCN(C(=O)c1ccc(Cl)cc1)C(=O)c1ccc(Cl)cc1

Molecular Weight¹

392.32

• 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	0.9237		Relay (1.0) Calculated Property
ΔfG°	160.58	kJ/mol	Joback Calculated Property
ΔfH°gas	-337.28	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	52.06	kJ/mol	Joback Calculated Property
ΔvapH°	111.39	kJ/mol	Relay (1.0) Calculated Property
IE	8.67	eV	Relay (1.0) Calculated Property
log10WS	-6.76		Relay (1.0) Calculated Property
logPoct/wat	6.246		Crippen Calculated Property
McVol	296.830	ml/mol	McGowan Calculated Property
Pc	1535.46	kPa	Joback Calculated Property
Inp	[2800.00; 2800.00]
Inp	2800.00		NIST
Inp	2800.00		NIST
Tboil	693.50	K	Relay (1.0) Calculated Property
Tc	956.75	K	Relay (1.0) Calculated Property
Tfus	336.09	K	Relay (1.0) Calculated Property
Vc	1.066	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[871.78; 936.30]	J/mol×K	[938.24; 1168.69]
Cp,gas	871.78	J/mol×K	938.24	Joback Calculated Property
Cp,gas	884.81	J/mol×K	976.65	Joback Calculated Property
Cp,gas	896.80	J/mol×K	1015.06	Joback Calculated Property
Cp,gas	907.85	J/mol×K	1053.47	Joback Calculated Property
Cp,gas	918.06	J/mol×K	1091.88	Joback Calculated Property
Cp,gas	927.51	J/mol×K	1130.28	Joback Calculated Property
Cp,gas	936.30	J/mol×K	1168.69	Joback Calculated Property

Similar Compounds

Find more compounds similar to 4-Chlorobenzamide, N-(4-chlorobenzoyl)-N-heptyl-.

Sources

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

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