Chemical Properties of 4-(4-hydroxy-3-methoxyphenyl)-1-butanol

InChI

InChI=1S/C11H16O3/c1-14-11-8-9(4-2-3-7-12)5-6-10(11)13/h5-6,8,12-13H,2-4,7H2,1H3

InChI Key

KYIMBEHWPPBVMI-UHFFFAOYSA-N

Formula

C11H16O3

SMILES

COc1cc(CCCCO)ccc1O

Molecular Weight¹

196.24

• C_p,gas : Ideal gas 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).
• 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).
• I : Polar retention indices.
• 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

Property	Value	Unit	Source
ΔfG°	-251.92	kJ/mol	Joback Calculated Property
ΔfH°gas	-507.07	kJ/mol	Joback Calculated Property
ΔfusH°	28.96	kJ/mol	Joback Calculated Property
ΔvapH°	75.12	kJ/mol	Joback Calculated Property
log10WS	-2.04		Crippen Calculated Property
logPoct/wat	1.716		Crippen Calculated Property
McVol	159.700	ml/mol	McGowan Calculated Property
Pc	3325.84	kPa	Joback Calculated Property
I	[2865.00; 2865.00]
I	2865.00		NIST
I	2865.00		NIST
Tboil	677.96	K	Joback Calculated Property
Tc	877.57	K	Joback Calculated Property
Tfus	447.44	K	Joback Calculated Property
Vc	0.546	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[433.92; 494.73]	J/mol×K	[677.96; 877.57]
Cp,gas	433.92	J/mol×K	677.96	Joback Calculated Property
Cp,gas	445.40	J/mol×K	711.23	Joback Calculated Property
Cp,gas	456.28	J/mol×K	744.50	Joback Calculated Property
Cp,gas	466.60	J/mol×K	777.77	Joback Calculated Property
Cp,gas	476.42	J/mol×K	811.04	Joback Calculated Property
Cp,gas	485.78	J/mol×K	844.31	Joback Calculated Property
Cp,gas	494.73	J/mol×K	877.57	Joback Calculated Property
η	[0.0000051; 0.0003844]	Pa×s	[447.44; 677.96]
η	0.0003844	Pa×s	447.44	Joback Calculated Property
η	0.0001408	Pa×s	485.86	Joback Calculated Property
η	0.0000597	Pa×s	524.28	Joback Calculated Property
η	0.0000285	Pa×s	562.70	Joback Calculated Property
η	0.0000149	Pa×s	601.12	Joback Calculated Property
η	0.0000085	Pa×s	639.54	Joback Calculated Property
η	0.0000051	Pa×s	677.96	Joback Calculated Property

Similar Compounds

Find more compounds similar to 4-(4-hydroxy-3-methoxyphenyl)-1-butanol.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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