Chemical Properties of Pentaphenyl benzene (CAS 18631-82-8)

InChI

InChI=1S/C36H26/c1-6-16-27(17-7-1)32-26-33(28-18-8-2-9-19-28)35(30-22-12-4-13-23-30)36(31-24-14-5-15-25-31)34(32)29-20-10-3-11-21-29/h1-26H

InChI Key

JULFJTZPJNNMQK-UHFFFAOYSA-N

Formula

C36H26

SMILES

c1ccc(-c2cc(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c2-c2ccccc2)cc1

Molecular Weight¹

458.59

CAS

18631-82-8

• 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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[435.84; 1153.29]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-1.76070e+02
Coefficient B			2.71240e+00
Coefficient C			-1.85364e-03
Coefficient D			4.70600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	435.84	J/mol×K	273.00	Calculated Property
Cp,gas	572.36	J/mol×K	353.78	Calculated Property
Cp,gas	691.20	J/mol×K	434.56	Calculated Property
Cp,gas	793.86	J/mol×K	515.33	Calculated Property
Cp,gas	881.82	J/mol×K	596.11	Calculated Property
Cp,gas	956.58	J/mol×K	676.89	Calculated Property
Cp,gas	1019.61	J/mol×K	757.67	Calculated Property
Cp,gas	1072.42	J/mol×K	838.44	Calculated Property
Cp,gas	1116.48	J/mol×K	919.22	Calculated Property
Cp,gas	1153.29	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0001288; 0.0000227]	Pa×s	[704.08; 1051.75]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.42058e+01
Coefficient B			3.69568e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			704.08
Temperature range, max.			1051.75
η	0.0001288	Pa×s	704.08	Calculated Property
η	0.0000981	Pa×s	742.71	Calculated Property
η	0.0000767	Pa×s	781.34	Calculated Property
η	0.0000614	Pa×s	819.97	Calculated Property
η	0.0000501	Pa×s	858.60	Calculated Property
η	0.0000416	Pa×s	897.23	Calculated Property
η	0.0000351	Pa×s	935.86	Calculated Property
η	0.0000300	Pa×s	974.49	Calculated Property
η	0.0000260	Pa×s	1013.12	Calculated Property
η	0.0000227	Pa×s	1051.75	Calculated Property

Similar Compounds

Find more compounds similar to Pentaphenyl benzene.

Sources

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

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