Chemical Properties of Tribenzo[a,ef,no]coronene (CAS 128345-68-6)

InChI

InChI=1S/C34H16/c1-2-10-24-23(9-1)25-15-19-7-3-5-17-13-21-11-12-22-14-18-6-4-8-20-16-26(24)32-31(25)33(27(17)19)29(21)30(22)34(32)28(18)20/h1-16H

InChI Key

UIIAIYRPNUYTMI-UHFFFAOYSA-N

Formula

C34H16

SMILES

c1cc2cc3ccc4cc5cccc6cc7c8ccccc8c8cc(c1)c2c1c3c4c(c56)c7c81

Molecular Weight¹

424.49

CAS

128345-68-6

• ω : Acentric Factor.
• 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).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1044.98; 1399.93]	J/mol×K	[1183.86; 1465.19]
Cp,gas	1044.98	J/mol×K	1183.86	Joback Calculated Property
Cp,gas	1086.84	J/mol×K	1230.75	Joback Calculated Property
Cp,gas	1134.65	J/mol×K	1277.64	Joback Calculated Property
Cp,gas	1189.14	J/mol×K	1324.53	Joback Calculated Property
Cp,gas	1251.03	J/mol×K	1371.42	Joback Calculated Property
Cp,gas	1321.06	J/mol×K	1418.30	Joback Calculated Property
Cp,gas	1399.93	J/mol×K	1465.19	Joback Calculated Property
η	[0.4024121; 0.4969759]	Pa×s	[918.94; 1183.86]
η	0.4024121	Pa×s	918.94	Joback Calculated Property
η	0.4201945	Pa×s	963.09	Joback Calculated Property
η	0.4371025	Pa×s	1007.25	Joback Calculated Property
η	0.4531868	Pa×s	1051.40	Joback Calculated Property
η	0.4684964	Pa×s	1095.55	Joback Calculated Property
η	0.4830780	Pa×s	1139.71	Joback Calculated Property
η	0.4969759	Pa×s	1183.86	Joback Calculated Property

Similar Compounds

Find more compounds similar to Tribenzo[a,ef,no]coronene.

Sources

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

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