Chemical Properties of 3-Aminobiphenyl, TFA

InChI

InChI=1S/C14H10F3NO/c15-14(16,17)13(19)18-12-8-4-7-11(9-12)10-5-2-1-3-6-10/h1-9H,(H,18,19)

InChI Key

HWOWNVQWIAMGRQ-UHFFFAOYSA-N

Formula

C14H10F3NO

SMILES

O=C(Nc1cccc(-c2ccccc2)c1)C(F)(F)F

Molecular Weight¹

265.23

• 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°	-338.93	kJ/mol	Joback Calculated Property
ΔfH°gas	-526.89	kJ/mol	Joback Calculated Property
ΔfusH°	28.23	kJ/mol	Joback Calculated Property
ΔvapH°	61.41	kJ/mol	Joback Calculated Property
log10WS	-4.94		Crippen Calculated Property
logPoct/wat	3.854		Crippen Calculated Property
McVol	177.460	ml/mol	McGowan Calculated Property
Pc	2616.41	kPa	Joback Calculated Property
Inp	[314.90; 315.38]
Inp	314.90		NIST
Inp	315.38		NIST
Tboil	676.68	K	Joback Calculated Property
Tc	902.13	K	Joback Calculated Property
Tfus	419.68	K	Joback Calculated Property
Vc	0.688	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[467.39; 531.32]	J/mol×K	[676.68; 902.13]
Cp,gas	467.39	J/mol×K	676.68	Joback Calculated Property
Cp,gas	480.59	J/mol×K	714.26	Joback Calculated Property
Cp,gas	492.66	J/mol×K	751.83	Joback Calculated Property
Cp,gas	503.68	J/mol×K	789.41	Joback Calculated Property
Cp,gas	513.74	J/mol×K	826.98	Joback Calculated Property
Cp,gas	522.92	J/mol×K	864.56	Joback Calculated Property
Cp,gas	531.32	J/mol×K	902.13	Joback Calculated Property

Similar Compounds

Find more compounds similar to 3-Aminobiphenyl, TFA.

Sources

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

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