Chemical Properties of p-Octyloxybenzyl alcohol (CAS 67698-68-4)

InChI

InChI=1S/C15H24O2/c1-2-3-4-5-6-7-12-17-15-10-8-14(13-16)9-11-15/h8-11,16H,2-7,12-13H2,1H3

InChI Key

BVSGXVHDNMPZSE-UHFFFAOYSA-N

Formula

C15H24O2

SMILES

CCCCCCCCOc1ccc(CO)cc1

Molecular Weight¹

236.35

CAS

67698-68-4

• 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).
• 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor 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	[296.89; 708.80]	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			4.38000e-01
Coefficient B			1.26122e+00
Coefficient C			-6.75760e-04
Coefficient D			1.22900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	296.89	J/mol×K	273.00	Calculated Property
Cp,gas	367.49	J/mol×K	353.78	Calculated Property
Cp,gas	430.98	J/mol×K	434.56	Calculated Property
Cp,gas	487.75	J/mol×K	515.33	Calculated Property
Cp,gas	538.17	J/mol×K	596.11	Calculated Property
Cp,gas	582.64	J/mol×K	676.89	Calculated Property
Cp,gas	621.55	J/mol×K	757.67	Calculated Property
Cp,gas	655.29	J/mol×K	838.44	Calculated Property
Cp,gas	684.24	J/mol×K	919.22	Calculated Property
Cp,gas	708.80	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0021103; 0.0000632]	Pa×s	[380.80; 610.86]	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			-1.54747e+01
Coefficient B			3.54668e+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.			380.80
Temperature range, max.			610.86
η	0.0021103	Pa×s	380.80	Calculated Property
η	0.0011747	Pa×s	406.36	Calculated Property
η	0.0007008	Pa×s	431.92	Calculated Property
η	0.0004429	Pa×s	457.49	Calculated Property
η	0.0002939	Pa×s	483.05	Calculated Property
η	0.0002032	Pa×s	508.61	Calculated Property
η	0.0001455	Pa×s	534.17	Calculated Property
η	0.0001075	Pa×s	559.73	Calculated Property
η	0.0000815	Pa×s	585.30	Calculated Property
η	0.0000632	Pa×s	610.86	Calculated Property

Similar Compounds

Find more compounds similar to p-Octyloxybenzyl alcohol.

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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