Chemical Properties of 6-hexyl-1,2,3,4-tetrahydronaphthalene (CAS 56598-72-2)

InChI

InChI=1S/C16H24/c1-2-3-4-5-8-14-11-12-15-9-6-7-10-16(15)13-14/h11-13H,2-10H2,1H3

InChI Key

XEERAPSBBRYSRL-UHFFFAOYSA-N

Formula

C16H24

SMILES

CCCCCCc1ccc2c(c1)CCCC2

Molecular Weight¹

216.36

CAS

56598-72-2

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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

Cheméo can also estimate Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[262.15; 695.03]	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			-7.82650e+01
Coefficient B			1.49372e+00
Coefficient C			-9.72920e-04
Coefficient D			2.52500e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	262.15	J/mol×K	273.00	Calculated Property
Cp,gas	339.59	J/mol×K	353.78	Calculated Property
Cp,gas	407.83	J/mol×K	434.56	Calculated Property
Cp,gas	467.68	J/mol×K	515.33	Calculated Property
Cp,gas	519.92	J/mol×K	596.11	Calculated Property
Cp,gas	565.36	J/mol×K	676.89	Calculated Property
Cp,gas	604.79	J/mol×K	757.67	Calculated Property
Cp,gas	639.01	J/mol×K	838.44	Calculated Property
Cp,gas	668.83	J/mol×K	919.22	Calculated Property
Cp,gas	695.03	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0021893; 0.0002797]	Pa×s	[340.20; 580.02]	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			-1.11010e+01
Coefficient B			1.69312e+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.			340.20
Temperature range, max.			580.02
η	0.0021893	Pa×s	340.20	Calculated Property
η	0.0015251	Pa×s	366.85	Calculated Property
η	0.0011158	Pa×s	393.49	Calculated Property
η	0.0008493	Pa×s	420.14	Calculated Property
η	0.0006678	Pa×s	446.79	Calculated Property
η	0.0005396	Pa×s	473.43	Calculated Property
η	0.0004459	Pa×s	500.08	Calculated Property
η	0.0003757	Pa×s	526.73	Calculated Property
η	0.0003219	Pa×s	553.37	Calculated Property
η	0.0002797	Pa×s	580.02	Calculated Property

Similar Compounds

Find more compounds similar to 6-hexyl-1,2,3,4-tetrahydronaphthalene.

Sources

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

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