Chemical Properties of Glutaric acid, hept-2-yl 4-fluoro-2-methoxyphenyl ester

InChI

InChI=1S/C19H27FO5/c1-4-5-6-8-14(2)24-18(21)9-7-10-19(22)25-16-12-11-15(20)13-17(16)23-3/h11-14H,4-10H2,1-3H3

InChI Key

KENXHSFDRJROBJ-UHFFFAOYSA-N

Formula

C19H27FO5

SMILES

CCCCCC(C)OC(=O)CCCC(=O)Oc1ccc(F)cc1OC

Molecular Weight¹

354.41

• 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°	-567.84	kJ/mol	Joback Calculated Property
ΔfH°gas	-1045.11	kJ/mol	Joback Calculated Property
ΔfusH°	44.55	kJ/mol	Joback Calculated Property
ΔvapH°	81.00	kJ/mol	Joback Calculated Property
log10WS	-5.40		Crippen Calculated Property
logPoct/wat	4.422		Crippen Calculated Property
McVol	277.330	ml/mol	McGowan Calculated Property
Pc	1368.70	kPa	Joback Calculated Property
Inp	[2306.00; 2306.00]
Inp	2306.00		NIST
Inp	2306.00		NIST
Tboil	844.59	K	Joback Calculated Property
Tc	1043.57	K	Joback Calculated Property
Tfus	507.49	K	Joback Calculated Property
Vc	1.069	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[855.32; 928.65]	J/mol×K	[844.59; 1043.57]
Cp,gas	855.32	J/mol×K	844.59	Joback Calculated Property
Cp,gas	870.40	J/mol×K	877.75	Joback Calculated Property
Cp,gas	884.33	J/mol×K	910.92	Joback Calculated Property
Cp,gas	897.12	J/mol×K	944.08	Joback Calculated Property
Cp,gas	908.76	J/mol×K	977.25	Joback Calculated Property
Cp,gas	919.27	J/mol×K	1010.41	Joback Calculated Property
Cp,gas	928.65	J/mol×K	1043.57	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, hept-2-yl 4-fluoro-2-methoxyphenyl ester.

Sources

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

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