Chemical Properties of Cyclohexanecarboxamide, N-(4-fluorophenyl)-

InChI

InChI=1S/C13H16FNO/c14-11-6-8-12(9-7-11)15-13(16)10-4-2-1-3-5-10/h6-10H,1-5H2,(H,15,16)

InChI Key

RQMDSCPCNJHYJL-UHFFFAOYSA-N

Formula

C13H16FNO

SMILES

O=C(Nc1ccc(F)cc1)C1CCCCC1

Molecular Weight¹

221.27

• 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°	-48.53	kJ/mol	Joback Calculated Property
ΔfH°gas	-287.49	kJ/mol	Joback Calculated Property
ΔfusH°	24.69	kJ/mol	Joback Calculated Property
ΔvapH°	60.26	kJ/mol	Joback Calculated Property
log10WS	-3.75		Crippen Calculated Property
logPoct/wat	3.344		Crippen Calculated Property
McVol	172.730	ml/mol	McGowan Calculated Property
Pc	2729.71	kPa	Joback Calculated Property
Inp	[1857.00; 1857.00]
Inp	1857.00		NIST
Inp	1857.00		NIST
Tboil	651.36	K	Joback Calculated Property
Tc	882.32	K	Joback Calculated Property
Tfus	385.77	K	Joback Calculated Property
Vc	0.647	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[469.15; 556.88]	J/mol×K	[651.36; 882.32]
Cp,gas	469.15	J/mol×K	651.36	Joback Calculated Property
Cp,gas	486.86	J/mol×K	689.85	Joback Calculated Property
Cp,gas	503.26	J/mol×K	728.35	Joback Calculated Property
Cp,gas	518.41	J/mol×K	766.84	Joback Calculated Property
Cp,gas	532.36	J/mol×K	805.33	Joback Calculated Property
Cp,gas	545.16	J/mol×K	843.82	Joback Calculated Property
Cp,gas	556.88	J/mol×K	882.32	Joback Calculated Property

Similar Compounds

Find more compounds similar to Cyclohexanecarboxamide, N-(4-fluorophenyl)-.

Sources

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

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