Chemical Properties of Glutaric acid, 2-fluorophenyl 2,6-dimethoxyphenyl ester

InChI

InChI=1S/C19H19FO6/c1-23-15-9-5-10-16(24-2)19(15)26-18(22)12-6-11-17(21)25-14-8-4-3-7-13(14)20/h3-5,7-10H,6,11-12H2,1-2H3

InChI Key

YXSZYMBBMVGLGW-UHFFFAOYSA-N

Formula

C19H19FO6

SMILES

COc1cccc(OC)c1OC(=O)CCCC(=O)Oc1ccccc1F

Molecular Weight¹

362.35

• ω : Acentric Factor.
• 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).
• 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	0.9514		Relay (1.0) Calculated Property
ΔfG°	-567.62	kJ/mol	Joback Calculated Property
ΔfH°gas	-1006.08	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	42.91	kJ/mol	Joback Calculated Property
ΔvapH°	109.50	kJ/mol	Relay (1.0) Calculated Property
IE	8.00	eV	Relay (1.0) Calculated Property
log10WS	-3.93		Relay (1.0) Calculated Property
logPoct/wat	3.524		Crippen Calculated Property
McVol	259.440	ml/mol	McGowan Calculated Property
Pc	1718.88	kPa	Joback Calculated Property
Inp	[2693.00; 2693.00]
Inp	2693.00		NIST
Inp	2693.00		NIST
Tboil	660.44	K	Relay (1.0) Calculated Property
Tc	906.68	K	Relay (1.0) Calculated Property
Tfus	366.99	K	Relay (1.0) Calculated Property
Vc	0.956	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[782.76; 833.71]	J/mol×K	[899.11; 1118.69]
Cp,gas	782.76	J/mol×K	899.11	Joback Calculated Property
Cp,gas	794.77	J/mol×K	935.71	Joback Calculated Property
Cp,gas	805.39	J/mol×K	972.30	Joback Calculated Property
Cp,gas	814.60	J/mol×K	1008.90	Joback Calculated Property
Cp,gas	822.40	J/mol×K	1045.49	Joback Calculated Property
Cp,gas	828.78	J/mol×K	1082.09	Joback Calculated Property
Cp,gas	833.71	J/mol×K	1118.69	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2-fluorophenyl 2,6-dimethoxyphenyl ester.

Sources

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

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