Chemical Properties of 2-Aminoanthracene TFA

InChI

InChI=1S/C16H10F3NO/c17-16(18,19)15(21)20-14-6-5-12-7-10-3-1-2-4-11(10)8-13(12)9-14/h1-9H,(H,20,21)

InChI Key

YCAWKKDPFUUHGA-UHFFFAOYSA-N

Formula

C16H10F3NO

SMILES

O=C(Nc1ccc2cc3ccccc3cc2c1)C(F)(F)F

Molecular Weight¹

289.25

• 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°	-230.83	kJ/mol	Joback Calculated Property
ΔfH°gas	-434.03	kJ/mol	Joback Calculated Property
ΔfusH°	33.02	kJ/mol	Joback Calculated Property
ΔvapH°	67.53	kJ/mol	Joback Calculated Property
log10WS	-5.95		Crippen Calculated Property
logPoct/wat	4.494		Crippen Calculated Property
McVol	190.480	ml/mol	McGowan Calculated Property
Pc	2492.52	kPa	Joback Calculated Property
Inp	[378.61; 378.61]
Inp	378.61		NIST
Inp	378.61		NIST
Tboil	738.70	K	Joback Calculated Property
Tc	966.83	K	Joback Calculated Property
Tfus	493.72	K	Joback Calculated Property
Vc	0.751	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[520.97; 580.05]	J/mol×K	[738.70; 966.83]
Cp,gas	520.97	J/mol×K	738.70	Joback Calculated Property
Cp,gas	532.68	J/mol×K	776.72	Joback Calculated Property
Cp,gas	543.46	J/mol×K	814.74	Joback Calculated Property
Cp,gas	553.45	J/mol×K	852.76	Joback Calculated Property
Cp,gas	562.79	J/mol×K	890.79	Joback Calculated Property
Cp,gas	571.61	J/mol×K	928.81	Joback Calculated Property
Cp,gas	580.05	J/mol×K	966.83	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Aminoanthracene TFA.

Sources

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

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