Chemical Properties of 4-Fluoro-2-methoxyphenol, acetate

InChI

InChI=1S/C9H9FO3/c1-6(11)13-8-4-3-7(10)5-9(8)12-2/h3-5H,1-2H3

InChI Key

AGAAKZLWQYHEGL-UHFFFAOYSA-N

Formula

C9H9FO3

SMILES

COc1cc(F)ccc1OC(C)=O

Molecular Weight¹

184.16

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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_np : Non-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°	-415.68	kJ/mol	Joback Calculated Property
ΔfH°gas	-588.63	kJ/mol	Joback Calculated Property
ΔfusH°	19.38	kJ/mol	Joback Calculated Property
ΔvapH°	49.98	kJ/mol	Joback Calculated Property
log10WS	-2.24		Crippen Calculated Property
logPoct/wat	1.760		Crippen Calculated Property
McVol	128.990	ml/mol	McGowan Calculated Property
Pc	3096.73	kPa	Joback Calculated Property
Inp	[1255.90; 1255.90]
Inp	1255.90		NIST
Inp	1255.90		NIST
Tboil	539.94	K	Joback Calculated Property
Tc	745.43	K	Joback Calculated Property
Tfus	337.63	K	Joback Calculated Property
Vc	0.491	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[286.79; 346.05]	J/mol×K	[539.94; 745.43]
Cp,gas	286.79	J/mol×K	539.94	Joback Calculated Property
Cp,gas	297.93	J/mol×K	574.19	Joback Calculated Property
Cp,gas	308.58	J/mol×K	608.44	Joback Calculated Property
Cp,gas	318.72	J/mol×K	642.69	Joback Calculated Property
Cp,gas	328.36	J/mol×K	676.94	Joback Calculated Property
Cp,gas	337.47	J/mol×K	711.19	Joback Calculated Property
Cp,gas	346.05	J/mol×K	745.43	Joback Calculated Property

Similar Compounds

Find more compounds similar to 4-Fluoro-2-methoxyphenol, acetate.

Sources

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

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