Chemical Properties of 4H-Cyclopenta[def]phenanthrenequinone

InChI

InChI=1S/C15H8O2/c16-14-10-5-1-3-8-7-9-4-2-6-11(15(14)17)13(9)12(8)10/h1-6H,7H2

InChI Key

AHDICIQOAZDBEN-UHFFFAOYSA-N

Formula

C15H8O2

SMILES

O=C1C(=O)c2cccc3c2-c2c(cccc21)C3

Molecular Weight¹

220.22

• 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°	189.76	kJ/mol	Joback Calculated Property
ΔfH°gas	3.61	kJ/mol	Joback Calculated Property
ΔfusH°	20.58	kJ/mol	Joback Calculated Property
ΔvapH°	64.61	kJ/mol	Joback Calculated Property
log10WS	-4.80		Crippen Calculated Property
logPoct/wat	2.637		Crippen Calculated Property
McVol	156.110	ml/mol	McGowan Calculated Property
Pc	3322.01	kPa	Joback Calculated Property
Inp	[342.64; 2195.00]
Inp	2195.00		NIST
Inp	342.64		NIST
Tboil	761.53	K	Joback Calculated Property
Tc	1031.86	K	Joback Calculated Property
Tfus	553.09	K	Joback Calculated Property
Vc	0.614	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[424.33; 489.83]	J/mol×K	[761.53; 1031.86]
Cp,gas	424.33	J/mol×K	761.53	Joback Calculated Property
Cp,gas	436.98	J/mol×K	806.59	Joback Calculated Property
Cp,gas	448.77	J/mol×K	851.64	Joback Calculated Property
Cp,gas	459.82	J/mol×K	896.70	Joback Calculated Property
Cp,gas	470.26	J/mol×K	941.75	Joback Calculated Property
Cp,gas	480.22	J/mol×K	986.81	Joback Calculated Property
Cp,gas	489.83	J/mol×K	1031.86	Joback Calculated Property

Similar Compounds

Find more compounds similar to 4H-Cyclopenta[def]phenanthrenequinone.

Sources

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

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