Chemical Properties of N-(3-Chlorophenyl)-2,2,3,3,3-pentafluoropropanamide (CAS 106376-32-3)

InChI

InChI=1S/C9H5ClF5NO/c10-5-2-1-3-6(4-5)16-7(17)8(11,12)9(13,14)15/h1-4H,(H,16,17)

InChI Key

LHXBLOCHDJHVNH-UHFFFAOYSA-N

Formula

C9H5ClF5NO

SMILES

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

Molecular Weight¹

273.59

CAS

106376-32-3

Other Names

• Propanamide, N-(3-chlorophenyl)-2,2,3,3,3-pentafluoro-

• 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°	-892.15	kJ/mol	Joback Calculated Property
ΔfH°gas	-1076.93	kJ/mol	Joback Calculated Property
ΔfusH°	24.19	kJ/mol	Joback Calculated Property
ΔvapH°	49.46	kJ/mol	Joback Calculated Property
log10WS	-3.75		Crippen Calculated Property
logPoct/wat	3.476		Crippen Calculated Property
McVol	146.550	ml/mol	McGowan Calculated Property
Pc	2729.71	kPa	Joback Calculated Property
Inp	[1291.00; 1300.00]
Inp	1300.00		NIST
Inp	1291.00		NIST
Inp	1300.00		NIST
Tboil	568.34	K	Joback Calculated Property
Tc	766.35	K	Joback Calculated Property
Tfus	370.43	K	Joback Calculated Property
Vc	0.590	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[351.44; 401.36]	J/mol×K	[568.34; 766.35]
Cp,gas	351.44	J/mol×K	568.34	Joback Calculated Property
Cp,gas	361.75	J/mol×K	601.34	Joback Calculated Property
Cp,gas	371.19	J/mol×K	634.34	Joback Calculated Property
Cp,gas	379.81	J/mol×K	667.34	Joback Calculated Property
Cp,gas	387.67	J/mol×K	700.35	Joback Calculated Property
Cp,gas	394.84	J/mol×K	733.35	Joback Calculated Property
Cp,gas	401.36	J/mol×K	766.35	Joback Calculated Property

Similar Compounds

Find more compounds similar to N-(3-Chlorophenyl)-2,2,3,3,3-pentafluoropropanamide.

Sources

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

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