Chemical Properties of Glutaric acid, 2-fluorophenyl 5-methyl-2-methoxybenzyl ester

InChI

InChI=1S/C19H19FO5/c1-13-10-11-16(23-2)17(12-13)25-19(22)9-5-8-18(21)24-15-7-4-3-6-14(15)20/h3-4,6-7,10-12H,5,8-9H2,1-2H3

InChI Key

LNORAPLFBVIUDH-UHFFFAOYSA-N

Formula

C19H19FO5

SMILES

COc1ccc(C)cc1OC(=O)CCCC(=O)Oc1ccccc1F

Molecular Weight¹

346.35

• 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°	-462.62	kJ/mol	Joback Calculated Property
ΔfH°gas	-814.77	kJ/mol	Joback Calculated Property
ΔfusH°	41.72	kJ/mol	Joback Calculated Property
ΔvapH°	84.33	kJ/mol	Joback Calculated Property
log10WS	-5.09		Crippen Calculated Property
logPoct/wat	3.824		Crippen Calculated Property
McVol	253.570	ml/mol	McGowan Calculated Property
Pc	1743.37	kPa	Joback Calculated Property
Inp	[2577.00; 2577.00]
Inp	2577.00		NIST
Inp	2577.00		NIST
Tboil	876.69	K	Joback Calculated Property
Tc	1096.42	K	Joback Calculated Property
Tfus	561.43	K	Joback Calculated Property
Vc	0.968	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[756.23; 813.47]	J/mol×K	[876.69; 1096.42]
Cp,gas	756.23	J/mol×K	876.69	Joback Calculated Property
Cp,gas	768.96	J/mol×K	913.31	Joback Calculated Property
Cp,gas	780.41	J/mol×K	949.93	Joback Calculated Property
Cp,gas	790.58	J/mol×K	986.56	Joback Calculated Property
Cp,gas	799.48	J/mol×K	1023.18	Joback Calculated Property
Cp,gas	807.10	J/mol×K	1059.80	Joback Calculated Property
Cp,gas	813.47	J/mol×K	1096.42	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2-fluorophenyl 5-methyl-2-methoxybenzyl ester.

Sources

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

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