Chemical Properties of 2,2'-Binaphthalene, 1,1',2,2',3,3',4,4'-octahydro- (CAS 27426-98-8)

InChI

InChI=1S/C20H22/c1-3-7-17-13-19(11-9-15(17)5-1)20-12-10-16-6-2-4-8-18(16)14-20/h1-8,19-20H,9-14H2

InChI Key

BXELUHKITUQVQG-UHFFFAOYSA-N

Formula

C20H22

SMILES

c1ccc2c(c1)CCC(C1CCc3ccccc3C1)C2

Molecular Weight¹

262.39

CAS

27426-98-8

Other Names

• 2,2'-Binaphthyl, 1,1',2,2',3,3',4,4'-octahydro-
• 2,2'-Bitetralin

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,liquid : Liquid 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_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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[263.68; 771.05]	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			-1.65230e+02
Coefficient B			1.90960e+00
Coefficient C			-1.34012e-03
Coefficient D			3.66800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	263.68	J/mol×K	273.00	Calculated Property
Cp,gas	358.86	J/mol×K	353.78	Calculated Property
Cp,gas	441.63	J/mol×K	434.56	Calculated Property
Cp,gas	513.16	J/mol×K	515.33	Calculated Property
Cp,gas	574.59	J/mol×K	596.11	Calculated Property
Cp,gas	627.10	J/mol×K	676.89	Calculated Property
Cp,gas	671.84	J/mol×K	757.67	Calculated Property
Cp,gas	709.97	J/mol×K	838.44	Calculated Property
Cp,gas	742.66	J/mol×K	919.22	Calculated Property
Cp,gas	771.05	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0020194; 0.0004656]	Pa×s	[421.88; 701.44]	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			-9.88615e+00
Coefficient B			1.55302e+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.			421.88
Temperature range, max.			701.44
η	0.0020194	Pa×s	421.88	Calculated Property
η	0.0015689	Pa×s	452.94	Calculated Property
η	0.0012590	Pa×s	484.00	Calculated Property
η	0.0010375	Pa×s	515.07	Calculated Property
η	0.0008740	Pa×s	546.13	Calculated Property
η	0.0007500	Pa×s	577.19	Calculated Property
η	0.0006537	Pa×s	608.25	Calculated Property
η	0.0005774	Pa×s	639.32	Calculated Property
η	0.0005159	Pa×s	670.38	Calculated Property
η	0.0004656	Pa×s	701.44	Calculated Property

Similar Compounds

Find more compounds similar to 2,2'-Binaphthalene, 1,1',2,2',3,3',4,4'-octahydro-.

Sources

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

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