Chemical Properties of 4-(4-Methoxyphenyl)-1-butanol

InChI

InChI=1S/C11H16O2/c1-13-11-7-5-10(6-8-11)4-2-3-9-12/h5-8,12H,2-4,9H2,1H3

InChI Key

ONIBHZIXCLTLNO-UHFFFAOYSA-N

Formula

C11H16O2

SMILES

COc1ccc(CCCCO)cc1

Molecular Weight¹

180.25

Other Names

• 4-(4-Methoxyphenyl)butan-1-ol
• 4-(p-Methoxyphenyl)butanol
• 4-Methoxybenzenebutanol
• Benzenebutanol, 4-methoxy-

• 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).
• 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_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization 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	[212.03; 502.43]	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			4.07400e+00
Coefficient B			8.81220e-01
Coefficient C			-4.58160e-04
Coefficient D			7.53000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	212.03	J/mol×K	273.00	Calculated Property
Cp,gas	261.82	J/mol×K	353.78	Calculated Property
Cp,gas	306.67	J/mol×K	434.56	Calculated Property
Cp,gas	346.83	J/mol×K	515.33	Calculated Property
Cp,gas	382.52	J/mol×K	596.11	Calculated Property
Cp,gas	414.00	J/mol×K	676.89	Calculated Property
Cp,gas	441.49	J/mol×K	757.67	Calculated Property
Cp,gas	465.23	J/mol×K	838.44	Calculated Property
Cp,gas	485.47	J/mol×K	919.22	Calculated Property
Cp,gas	502.43	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0304702; 0.0001013]	Pa×s	[276.65; 551.12]	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			-1.49497e+01
Coefficient B			3.17004e+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.			276.65
Temperature range, max.			551.12
η	0.0304702	Pa×s	276.65	Calculated Property
η	0.0097672	Pa×s	307.15	Calculated Property
η	0.0038452	Pa×s	337.64	Calculated Property
η	0.0017666	Pa×s	368.14	Calculated Property
η	0.0009142	Pa×s	398.63	Calculated Property
η	0.0005195	Pa×s	429.13	Calculated Property
η	0.0003182	Pa×s	459.63	Calculated Property
η	0.0002072	Pa×s	490.12	Calculated Property
η	0.0001419	Pa×s	520.62	Calculated Property
η	0.0001013	Pa×s	551.12	Calculated Property

Similar Compounds

Find more compounds similar to 4-(4-Methoxyphenyl)-1-butanol.

Sources

• Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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