Chemical Properties of Naphtho[1,2-a]anthracene (CAS 195-06-2)

InChI

InChI=1S/C22H14/c1-2-7-18-14-21-19(13-17(18)6-1)12-11-16-10-9-15-5-3-4-8-20(15)22(16)21/h1-14H

InChI Key

HAJMQPPSPOBCLG-UHFFFAOYSA-N

Formula

C22H14

SMILES

c1ccc2cc3c(ccc4ccc5ccccc5c43)cc2c1

Molecular Weight¹

278.35

CAS

195-06-2

Other Names

• 2,3:5,6-Dibenzophenanthrene
• Dibenzo[b,g]phenanthrene

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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
ΔfG°	644.48	kJ/mol	Joback Calculated Property
ΔfH°gas	468.99	kJ/mol	Joback Calculated Property
ΔfusH°	33.69	kJ/mol	Joback Calculated Property
ΔvapH°	75.39	kJ/mol	Joback Calculated Property
IE	[7.11; 7.33]	eV
IE	7.33	eV	NIST
IE	7.11	eV	NIST
log10WS	-8.69		Crippen Calculated Property
logPoct/wat	6.299		Crippen Calculated Property
McVol	219.240	ml/mol	McGowan Calculated Property
Pc	2347.36	kPa	Joback Calculated Property
Inp	[485.71; 485.71]
Inp	485.71		NIST
Inp	485.71		NIST
Tboil	820.30	K	Joback Calculated Property
Tc	1089.89	K	Joback Calculated Property
Tfus	532.48	K	Joback Calculated Property
Vc	0.848	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[607.64; 691.04]	J/mol×K	[820.30; 1089.89]
Cp,gas	607.64	J/mol×K	820.30	Joback Calculated Property
Cp,gas	622.45	J/mol×K	865.23	Joback Calculated Property
Cp,gas	636.52	J/mol×K	910.16	Joback Calculated Property
Cp,gas	650.13	J/mol×K	955.09	Joback Calculated Property
Cp,gas	663.56	J/mol×K	1000.03	Joback Calculated Property
Cp,gas	677.10	J/mol×K	1044.96	Joback Calculated Property
Cp,gas	691.04	J/mol×K	1089.89	Joback Calculated Property
η	[0.0011148; 0.0022584]	Pa×s	[532.48; 820.30]
η	0.0022584	Pa×s	532.48	Joback Calculated Property
η	0.0019125	Pa×s	580.45	Joback Calculated Property
η	0.0016611	Pa×s	628.42	Joback Calculated Property
η	0.0014719	Pa×s	676.39	Joback Calculated Property
η	0.0013254	Pa×s	724.36	Joback Calculated Property
η	0.0012090	Pa×s	772.33	Joback Calculated Property
η	0.0011148	Pa×s	820.30	Joback Calculated Property

Similar Compounds

Find more compounds similar to Naphtho[1,2-a]anthracene.

Sources

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

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