Chemical Properties of 2-(Bis(2,2,3,3,3-pentafluoropropanoyl)amino)phenyl 2,2,3,3,3-pentafluoropropanoate

InChI

InChI=1S/C15H4F15NO4/c16-10(17,13(22,23)24)7(32)31(8(33)11(18,19)14(25,26)27)5-3-1-2-4-6(5)35-9(34)12(20,21)15(28,29)30/h1-4H

InChI Key

PJQWHOYZRDQXEZ-UHFFFAOYSA-N

Formula

C15H4F15NO4

SMILES

O=C(Oc1ccccc1N(C(=O)C(F)(F)C(F)(F)F)C(=O)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)F

Molecular Weight¹

547.17

Other Names

• o-Aminophenol, N,N,O-tris(pentafluoropropionyl)-

• 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	0.7925		Relay (1.0) Calculated Property
ΔfG°	-3107.89	kJ/mol	Joback Calculated Property
ΔfH°gas	-3678.86	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	38.98	kJ/mol	Joback Calculated Property
ΔvapH°	84.06	kJ/mol	Relay (1.0) Calculated Property
IE	9.82	eV	Relay (1.0) Calculated Property
log10WS	-7.66		Relay (1.0) Calculated Property
logPoct/wat	5.044		Crippen Calculated Property
McVol	245.560	ml/mol	McGowan Calculated Property
Pc	1338.82	kPa	Joback Calculated Property
Inp	[1141.00; 1141.00]
Inp	1141.00		NIST
Inp	1141.00		NIST
Tboil	508.97	K	Relay (1.0) Calculated Property
Tc	706.73	K	Relay (1.0) Calculated Property
Tfus	359.62	K	Relay (1.0) Calculated Property
Vc	0.951	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[753.71; 795.16]	J/mol×K	[740.40; 911.42]
Cp,gas	753.71	J/mol×K	740.40	Joback Calculated Property
Cp,gas	762.37	J/mol×K	768.90	Joback Calculated Property
Cp,gas	770.22	J/mol×K	797.41	Joback Calculated Property
Cp,gas	777.33	J/mol×K	825.91	Joback Calculated Property
Cp,gas	783.80	J/mol×K	854.41	Joback Calculated Property
Cp,gas	789.71	J/mol×K	882.92	Joback Calculated Property
Cp,gas	795.16	J/mol×K	911.42	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-(Bis(2,2,3,3,3-pentafluoropropanoyl)amino)phenyl 2,2,3,3,3-pentafluoropropanoate.

Sources

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

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