Chemical Properties of Benzamide, N-(3-chlorophenyl)-2,6-difluoro-

InChI

InChI=1S/C13H8ClF2NO/c14-8-3-1-4-9(7-8)17-13(18)12-10(15)5-2-6-11(12)16/h1-7H,(H,17,18)

InChI Key

LZWCYTYURGFFOM-UHFFFAOYSA-N

Formula

C13H8ClF2NO

SMILES

O=C(Nc1cccc(Cl)c1)c1c(F)cccc1F

Molecular Weight¹

267.66

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion 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).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	33.40	kJ/mol	Joback Calculated Property
IE	8.50	eV	Relay (1.0) Calculated Property
log10WS	-5.17		Relay (1.0) Calculated Property
logPoct/wat	3.870		Crippen Calculated Property
McVol	173.840	ml/mol	McGowan Calculated Property
Inp	[2058.00; 2058.00]
Inp	2058.00		NIST
Inp	2058.00		NIST
Tboil	605.58	K	Relay (1.0) Calculated Property
Tfus	395.63	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[426.65; 481.87]	J/mol×K	[705.15; 936.96]
Cp,gas	426.65	J/mol×K	705.15	Joback Calculated Property
Cp,gas	438.02	J/mol×K	743.78	Joback Calculated Property
Cp,gas	448.45	J/mol×K	782.42	Joback Calculated Property
Cp,gas	458.01	J/mol×K	821.05	Joback Calculated Property
Cp,gas	466.73	J/mol×K	859.69	Joback Calculated Property
Cp,gas	474.67	J/mol×K	898.32	Joback Calculated Property
Cp,gas	481.87	J/mol×K	936.96	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, N-(3-chlorophenyl)-2,6-difluoro-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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