Chemical Properties of Tetrabenzo[bc,ef,hi,kl]coronene (CAS 128366-79-0)

InChI

InChI=1S/C36H16/c1-5-17-15-19-13-14-20-16-18-6-2-8-22-24-10-4-12-26-25-11-3-9-23-21(7-1)27(17)33-29(19)30(20)34(28(18)22)36(32(24)26)35(33)31(23)25/h1-16H

InChI Key

OUYAOGXTUHPYGO-UHFFFAOYSA-N

Formula

C36H16

SMILES

c1cc2cc3ccc4cc5cccc6c7cccc8c9cccc%10c(c1)c2c1c3c4c(c56)c(c78)c1c%109

Molecular Weight¹

448.51

CAS

128366-79-0

• 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	[1158.15; 1646.14]	J/mol×K	[1245.88; 1533.31]
Cp,gas	1158.15	J/mol×K	1245.88	Joback Calculated Property
Cp,gas	1215.75	J/mol×K	1293.79	Joback Calculated Property
Cp,gas	1281.69	J/mol×K	1341.69	Joback Calculated Property
Cp,gas	1356.83	J/mol×K	1389.60	Joback Calculated Property
Cp,gas	1442.05	J/mol×K	1437.50	Joback Calculated Property
Cp,gas	1538.20	J/mol×K	1485.41	Joback Calculated Property
Cp,gas	1646.14	J/mol×K	1533.31	Joback Calculated Property
η	[1.7231260; 2.2745745]	Pa×s	[992.98; 1245.88]
η	1.7231260	Pa×s	992.98	Joback Calculated Property
η	1.8218221	Pa×s	1035.13	Joback Calculated Property
η	1.9177944	Pa×s	1077.28	Joback Calculated Property
η	2.0110325	Pa×s	1119.43	Joback Calculated Property
η	2.1015508	Pa×s	1161.58	Joback Calculated Property
η	2.1893823	Pa×s	1203.73	Joback Calculated Property
η	2.2745745	Pa×s	1245.88	Joback Calculated Property

Similar Compounds

Find more compounds similar to Tetrabenzo[bc,ef,hi,kl]coronene.

Sources

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

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