Chemical Properties of Naphthalene, 1,2,3,4,4a,5,6,7-octahydro-8-methoxy- (CAS 101555-42-4)

InChI

InChI=1S/C11H18O/c1-12-11-8-4-6-9-5-2-3-7-10(9)11/h9H,2-8H2,1H3

InChI Key

JWGZDJQGJGEAAT-UHFFFAOYSA-N

Formula

C11H18O

SMILES

COC1=C2CCCCC2CCC1

Molecular Weight¹

166.26

CAS

101555-42-4

• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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	[184.15; 527.88]	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			-7.21400e+01
Coefficient B			1.10052e+00
Coefficient C			-6.27000e-04
Coefficient D			1.26500e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	184.15	J/mol×K	273.00	Calculated Property
Cp,gas	244.33	J/mol×K	353.78	Calculated Property
Cp,gas	298.08	J/mol×K	434.56	Calculated Property
Cp,gas	345.80	J/mol×K	515.33	Calculated Property
Cp,gas	387.88	J/mol×K	596.11	Calculated Property
Cp,gas	424.74	J/mol×K	676.89	Calculated Property
Cp,gas	456.77	J/mol×K	757.67	Calculated Property
Cp,gas	484.37	J/mol×K	838.44	Calculated Property
Cp,gas	507.94	J/mol×K	919.22	Calculated Property
Cp,gas	527.88	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0023575; 0.0002986]	Pa×s	[287.80; 517.56]	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			-1.07044e+01
Coefficient B			1.33950e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			287.80
Temperature range, max.			517.56
η	0.0023575	Pa×s	287.80	Calculated Property
η	0.0016135	Pa×s	313.33	Calculated Property
η	0.0011692	Pa×s	338.86	Calculated Property
η	0.0008864	Pa×s	364.39	Calculated Property
η	0.0006968	Pa×s	389.92	Calculated Property
η	0.0005642	Pa×s	415.44	Calculated Property
η	0.0004681	Pa×s	440.97	Calculated Property
η	0.0003964	Pa×s	466.50	Calculated Property
η	0.0003415	Pa×s	492.03	Calculated Property
η	0.0002986	Pa×s	517.56	Calculated Property

Similar Compounds

Find more compounds similar to Naphthalene, 1,2,3,4,4a,5,6,7-octahydro-8-methoxy-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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