Chemical Properties of 1,1':4',1'':4'',1''':4''',1''''-Quinquephenyl (CAS 3073-05-0)

InChI

InChI=1S/C30H22/c1-3-7-23(8-4-1)25-11-15-27(16-12-25)29-19-21-30(22-20-29)28-17-13-26(14-18-28)24-9-5-2-6-10-24/h1-22H

InChI Key

OMCUOJTVNIHQTI-UHFFFAOYSA-N

Formula

C30H22

SMILES

c1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)cc2)cc1

Molecular Weight¹

382.50

CAS

3073-05-0

Other Names

• p-Pentaphenyl
• p-Quinquiphenyl
• p-quinquephenyl

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,solid : Solid phase 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_fusH : Enthalpy of fusion at a given temperature (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).
• Δ_fusS : Entropy of fusion at a given temperature (J/mol×K).
• 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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[363.26; 965.31]	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			-1.51010e+02
Coefficient B			2.28080e+00
Coefficient C			-1.56308e-03
Coefficient D			3.98600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	363.26	J/mol×K	273.00	Calculated Property
Cp,gas	477.90	J/mol×K	353.78	Calculated Property
Cp,gas	577.66	J/mol×K	434.56	Calculated Property
Cp,gas	663.81	J/mol×K	515.33	Calculated Property
Cp,gas	737.60	J/mol×K	596.11	Calculated Property
Cp,gas	800.29	J/mol×K	676.89	Calculated Property
Cp,gas	853.15	J/mol×K	757.67	Calculated Property
Cp,gas	897.43	J/mol×K	838.44	Calculated Property
Cp,gas	934.40	J/mol×K	919.22	Calculated Property
Cp,gas	965.31	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0001991; 0.0000452]	Pa×s	[645.00; 926.38]	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			-1.34033e+01
Coefficient B			3.14856e+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.			645.00
Temperature range, max.			926.38
η	0.0001991	Pa×s	645.00	Calculated Property
η	0.0001589	Pa×s	676.26	Calculated Property
η	0.0001293	Pa×s	707.53	Calculated Property
η	0.0001071	Pa×s	738.79	Calculated Property
η	0.0000901	Pa×s	770.06	Calculated Property
η	0.0000768	Pa×s	801.32	Calculated Property
η	0.0000663	Pa×s	832.59	Calculated Property
η	0.0000578	Pa×s	863.85	Calculated Property
η	0.0000509	Pa×s	895.12	Calculated Property
η	0.0000452	Pa×s	926.38	Calculated Property

Similar Compounds

Find more compounds similar to 1,1':4',1'':4'',1''':4''',1''''-Quinquephenyl.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Isomerization effect on the heat capacities and phase behavior of oligophenyls isomers series
• Joback Method
• McGowan Method
• NIST Webbook

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