Chemical Properties of Cyclohexanecarboxylic acid, 4-methoxy-

InChI

InChI=1S/C8H14O3/c1-11-7-4-2-6(3-5-7)8(9)10/h6-7H,2-5H2,1H3,(H,9,10)

InChI Key

WKILSRYNRQGRMA-UHFFFAOYSA-N

Formula

C8H14O3

SMILES

COC1CCC(C(=O)O)CC1

Molecular Weight¹

158.19

• ω : Acentric Factor.
• 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).
• 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).
• 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
ω	0.6091		Relay (1.0) Calculated Property
ΔfG°	-337.52	kJ/mol	Joback Calculated Property
ΔfH°gas	-585.40	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	16.26	kJ/mol	Joback Calculated Property
ΔvapH°	83.21	kJ/mol	Relay (1.0) Calculated Property
IE	9.67	eV	Relay (1.0) Calculated Property
log10WS	-0.14		Relay (1.0) Calculated Property
logPoct/wat	1.276		Crippen Calculated Property
McVol	126.030	ml/mol	McGowan Calculated Property
Pc	3560.02	kPa	Joback Calculated Property
Inp	[1410.00; 1410.00]
Inp	1410.00		NIST
Inp	1410.00		NIST
Tboil	537.76	K	Relay (1.0) Calculated Property
Tc	740.37	K	Relay (1.0) Calculated Property
Tfus	325.24	K	Relay (1.0) Calculated Property
Vc	0.432	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[321.94; 394.77]	J/mol×K	[565.79; 763.42]
Cp,gas	321.94	J/mol×K	565.79	Joback Calculated Property
Cp,gas	335.79	J/mol×K	598.73	Joback Calculated Property
Cp,gas	348.96	J/mol×K	631.67	Joback Calculated Property
Cp,gas	361.43	J/mol×K	664.60	Joback Calculated Property
Cp,gas	373.23	J/mol×K	697.54	Joback Calculated Property
Cp,gas	384.34	J/mol×K	730.48	Joback Calculated Property
Cp,gas	394.77	J/mol×K	763.42	Joback Calculated Property
η	[0.0001249; 0.0085780]	Pa×s	[316.04; 565.79]
η	0.0085780	Pa×s	316.04	Joback Calculated Property
η	0.0028126	Pa×s	357.67	Joback Calculated Property
η	0.0011636	Pa×s	399.29	Joback Calculated Property
η	0.0005687	Pa×s	440.91	Joback Calculated Property
η	0.0003145	Pa×s	482.54	Joback Calculated Property
η	0.0001910	Pa×s	524.16	Joback Calculated Property
η	0.0001249	Pa×s	565.79	Joback Calculated Property

Similar Compounds

Find more compounds similar to Cyclohexanecarboxylic acid, 4-methoxy-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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