Chemical Properties of 1,1':3',1''-Terphenyl, 5'-phenyl- (CAS 612-71-5)

InChI

InChI=1S/C24H18/c1-4-10-19(11-5-1)22-16-23(20-12-6-2-7-13-20)18-24(17-22)21-14-8-3-9-15-21/h1-18H

InChI Key

SXWIAEOZZQADEY-UHFFFAOYSA-N

Formula

C24H18

SMILES

c1ccc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)cc1

Molecular Weight¹

306.40

CAS

612-71-5

Other Names

• 1,1'-Biphenyl, 3,5-diphenyl-
• 1,3,5-triphenylbenzene
• 5'-Phenyl-1,1':3',1''-terphenyl
• 5'-Phenyl-m-terphenyl
• NSC 17358
• Symmetrical triphenylbenzene
• Triphenylbenzene
• benzene, 1,3,5-triphenyl-
• m-Terphenyl, 5'-phenyl-
• s-Triphenylbenzene

• ω : Acentric Factor.
• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• 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_fH°_solid : Solid phase 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_subH : Enthalpy of sublimation at a given temperature (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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).
• P_sub : Sublimation pressure (kPa).
• P_vap : Vapor pressure (kPa).
• I_np : Non-polar retention indices.
• Δ_fusS : Entropy of fusion at a given temperature (J/mol×K).
• S°_{solid,1 bar} : Solid phase molar entropy at standard conditions (J/mol×K).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• T_triple : Triple Point Temperature (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.5523		Relay (1.0) Calculated Property
ΔcH°solid	-12241.30 ± 5.30	kJ/mol	NIST
ΔfG°	581.58	kJ/mol	Joback Calculated Property
ΔfH°gas	371.80 ± 3.80	kJ/mol	NIST
ΔfH°solid	[222.00; 224.60]	kJ/mol
ΔfH°solid	222.00 ± 3.40	kJ/mol	NIST
ΔfH°solid	224.60 ± 5.40	kJ/mol	NIST
ΔfusH°	[31.10; 149.50]	kJ/mol
ΔfusH°	147.70	kJ/mol	New Knudsen effusion apparatus with simultaneous gravimetric and quartz crystal microbalance mass loss detection
ΔfusH°	147.90	kJ/mol	New Knudsen effusion apparatus with simultaneous gravimetric and quartz crystal microbalance mass loss detection
ΔfusH°	148.40	kJ/mol	New Knudsen effusion apparatus with simultaneous gravimetric and quartz crystal microbalance mass loss detection
ΔfusH°	149.50	kJ/mol	New Knudsen effusion apparatus with simultaneous gravimetric and quartz crystal microbalance mass loss detection
ΔfusH°	31.10	kJ/mol	Vapor Pressures and Vaporization Enthalpies of the n-Alkanes from C31 to C38 at T = 298.15 K by Correlation Gas Chromatography
ΔvapH°	[133.40; 140.00]	kJ/mol
ΔvapH°	133.40 ± 2.00	kJ/mol	NIST
ΔvapH°	140.00	kJ/mol	NIST
IE	7.79	eV	Relay (1.0) Calculated Property
log10WS	-8.87		Relay (1.0) Calculated Property
logPoct/wat	6.688		Crippen Calculated Property
McVol	253.980	ml/mol	McGowan Calculated Property
Pc	2014.51	kPa	Joback Calculated Property
Inp	[469.48; 2891.00]
Inp	2891.00		NIST
Inp	469.48		NIST
S°solid,1 bar	[367.40; 375.50]	J/mol×K
S°solid,1 bar	375.50	J/mol×K	NIST
S°solid,1 bar	367.40	J/mol×K	NIST
Tboil	733.20	K	NIST
Tc	1017.06	K	Relay (1.0) Calculated Property
Tfus	[444.00; 450.10]	K
Tfus	450.10 ± 4.00	K	NIST
Tfus	448.00 ± 0.30	K	NIST
Tfus	444.00 ± 1.50	K	NIST
Tfus	446.00 ± 3.00	K	NIST
Ttriple	446.00 ± 1.00	K	NIST
Vc	0.940	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[732.93; 813.64]	J/mol×K	[865.20; 1146.33]
Cp,gas	732.93	J/mol×K	865.20	Joback Calculated Property
Cp,gas	749.87	J/mol×K	912.06	Joback Calculated Property
Cp,gas	765.15	J/mol×K	958.91	Joback Calculated Property
Cp,gas	778.96	J/mol×K	1005.77	Joback Calculated Property
Cp,gas	791.51	J/mol×K	1052.62	Joback Calculated Property
Cp,gas	803.00	J/mol×K	1099.48	Joback Calculated Property
Cp,gas	813.64	J/mol×K	1146.33	Joback Calculated Property
Cp,solid	[357.96; 361.00]	J/mol×K	[298.10; 298.15]
Cp,solid	358.32	J/mol×K	298.10	NIST
Cp,solid	357.96	J/mol×K	298.15	Reassembling and testing of a high-precision heat capacity drop calorimeter. Heat capacity of some polyphenyls at T = 298.15 K
Cp,solid	361.00	J/mol×K	298.15	NIST
η	[0.0000654; 0.0006475]	Pa×s	[490.96; 865.20]
η	0.0006475	Pa×s	490.96	Joback Calculated Property
η	0.0003563	Pa×s	553.33	Joback Calculated Property
η	0.0002213	Pa×s	615.71	Joback Calculated Property
η	0.0001500	Pa×s	678.08	Joback Calculated Property
η	0.0001086	Pa×s	740.45	Joback Calculated Property
η	0.0000827	Pa×s	802.83	Joback Calculated Property
η	0.0000654	Pa×s	865.20	Joback Calculated Property
ΔfusH	[32.60; 33.40]	kJ/mol	[445.20; 446.00]
ΔfusH	32.60	kJ/mol	445.20	NIST
ΔfusH	33.40	kJ/mol	446.00	NIST
ΔfusH	33.40	kJ/mol	446.00	NIST
ΔfusH	33.40	kJ/mol	446.00	NIST
ΔsubH	[141.20; 164.40]	kJ/mol	[363.00; 427.00]
ΔsubH	164.40 ± 4.20	kJ/mol	363.00	NIST
ΔsubH	145.60 ± 0.90	kJ/mol	376.00	NIST
ΔsubH	142.20	kJ/mol	392.00	NIST
ΔsubH	141.20 ± 0.70	kJ/mol	418.00	NIST
ΔsubH	142.00	kJ/mol	427.00	NIST
ΔvapH	[77.50; 118.00]	kJ/mol	[477.00; 617.50]
ΔvapH	118.00	kJ/mol	477.00	NIST
ΔvapH	77.50	kJ/mol	617.50	NIST
Psub	[1.39e-04; 1.20e-03]	kPa	[407.36; 429.29]
Psub	1.40e-04	kPa	407.36	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	1.41e-04	kPa	407.36	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	1.39e-04	kPa	407.36	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	1.44e-04	kPa	408.04	Development of the Knudsen effusion methodology for vapour pressure measurements of low volatile liquids and solids based on a quartz crystal microbalance
Psub	1.49e-04	kPa	408.05	Development of the Knudsen effusion methodology for vapour pressure measurements of low volatile liquids and solids based on a quartz crystal microbalance
Psub	1.54e-04	kPa	408.16	Development of the Knudsen effusion methodology for vapour pressure measurements of low volatile liquids and solids based on a quartz crystal microbalance
Psub	1.66e-04	kPa	409.30	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	1.64e-04	kPa	409.30	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	1.73e-04	kPa	409.30	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	2.10e-04	kPa	411.30	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	2.06e-04	kPa	411.30	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	2.15e-04	kPa	411.30	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	2.38e-04	kPa	413.04	Development of the Knudsen effusion methodology for vapour pressure measurements of low volatile liquids and solids based on a quartz crystal microbalance
Psub	2.47e-04	kPa	413.05	Development of the Knudsen effusion methodology for vapour pressure measurements of low volatile liquids and solids based on a quartz crystal microbalance
Psub	2.53e-04	kPa	413.16	Development of the Knudsen effusion methodology for vapour pressure measurements of low volatile liquids and solids based on a quartz crystal microbalance
Psub	2.56e-04	kPa	413.23	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	2.51e-04	kPa	413.23	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	2.51e-04	kPa	413.23	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	3.17e-04	kPa	415.35	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	3.16e-04	kPa	415.35	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	3.16e-04	kPa	415.35	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	3.61e-04	kPa	416.86	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	3.48e-04	kPa	416.86	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	3.70e-04	kPa	417.22	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	3.71e-04	kPa	417.22	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	3.88e-04	kPa	418.03	Development of the Knudsen effusion methodology for vapour pressure measurements of low volatile liquids and solids based on a quartz crystal microbalance
Psub	4.03e-04	kPa	418.05	Development of the Knudsen effusion methodology for vapour pressure measurements of low volatile liquids and solids based on a quartz crystal microbalance
Psub	4.16e-04	kPa	418.15	Development of the Knudsen effusion methodology for vapour pressure measurements of low volatile liquids and solids based on a quartz crystal microbalance
Psub	4.70e-04	kPa	419.24	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	4.54e-04	kPa	419.24	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	5.63e-04	kPa	421.36	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	5.42e-04	kPa	421.36	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	5.68e-04	kPa	421.36	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	6.22e-04	kPa	423.03	Development of the Knudsen effusion methodology for vapour pressure measurements of low volatile liquids and solids based on a quartz crystal microbalance
Psub	6.34e-04	kPa	423.03	Development of the Knudsen effusion methodology for vapour pressure measurements of low volatile liquids and solids based on a quartz crystal microbalance
Psub	6.48e-04	kPa	423.04	Development of the Knudsen effusion methodology for vapour pressure measurements of low volatile liquids and solids based on a quartz crystal microbalance
Psub	6.72e-04	kPa	423.16	Development of the Knudsen effusion methodology for vapour pressure measurements of low volatile liquids and solids based on a quartz crystal microbalance
Psub	6.72e-04	kPa	423.29	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	6.68e-04	kPa	423.29	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	6.49e-04	kPa	423.29	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	7.84e-04	kPa	425.26	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	7.96e-04	kPa	425.26	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	9.84e-04	kPa	427.36	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	9.66e-04	kPa	427.36	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	1.00e-03	kPa	427.36	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	9.83e-04	kPa	428.03	Development of the Knudsen effusion methodology for vapour pressure measurements of low volatile liquids and solids based on a quartz crystal microbalance
Psub	1.03e-03	kPa	428.04	Development of the Knudsen effusion methodology for vapour pressure measurements of low volatile liquids and solids based on a quartz crystal microbalance
Psub	1.08e-03	kPa	428.16	Development of the Knudsen effusion methodology for vapour pressure measurements of low volatile liquids and solids based on a quartz crystal microbalance
Psub	1.20e-03	kPa	429.29	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	1.17e-03	kPa	429.29	The design, construction, and testing of a new Knudsen effusion apparatus
Psub	1.20e-03	kPa	429.29	The design, construction, and testing of a new Knudsen effusion apparatus
Pvap	[5.47e-10; 0.19]	kPa	[298.15; 510.00]
Pvap	5.47e-10	kPa	298.15	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	7.65e-10	kPa	300.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	4.30e-09	kPa	310.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	2.12e-08	kPa	320.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	9.25e-08	kPa	330.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	3.62e-07	kPa	340.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	1.28e-06	kPa	350.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	4.16e-06	kPa	360.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	1.24e-05	kPa	370.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	3.44e-05	kPa	380.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	8.89e-05	kPa	390.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	2.16e-04	kPa	400.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	4.94e-04	kPa	410.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	1.07e-03	kPa	420.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	2.22e-03	kPa	430.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	4.39e-03	kPa	440.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	8.31e-03	kPa	450.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	0.02	kPa	460.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	0.03	kPa	470.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	0.05	kPa	480.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	0.08	kPa	490.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	0.12	kPa	500.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
Pvap	0.19	kPa	510.00	Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
ΔfusS	75.10	J/mol×K	446.00	NIST

Similar Compounds

Find more compounds similar to 1,1':3',1''-Terphenyl, 5'-phenyl-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• The design, construction, and testing of a new Knudsen effusion apparatus
• New Knudsen effusion apparatus with simultaneous gravimetric and quartz crystal microbalance mass loss detection
• Reassembling and testing of a high-precision heat capacity drop calorimeter. Heat capacity of some polyphenyls at T = 298.15 K
• Development of the Knudsen effusion methodology for vapour pressure measurements of low volatile liquids and solids based on a quartz crystal microbalance
• Vapor Pressures and Vaporization Enthalpies of the n-Alkanes from C31 to C38 at T = 298.15 K by Correlation Gas Chromatography
• Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.