Chemical Properties of Glutaric acid, 2,2,3,3-tetrafluoropropyl 4-chloro-2-methoxyphenyl ester

InChI

InChI=1S/C15H15ClF4O5/c1-23-11-7-9(16)5-6-10(11)25-13(22)4-2-3-12(21)24-8-15(19,20)14(17)18/h5-7,14H,2-4,8H2,1H3

InChI Key

XIJSRLDPFJUGCZ-UHFFFAOYSA-N

Formula

C15H15ClF4O5

SMILES

COc1cc(Cl)ccc1OC(=O)CCCC(=O)OCC(F)(F)C(F)F

Molecular Weight¹

386.72

• 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°	-1195.04	kJ/mol	Joback Calculated Property
ΔfH°gas	-1575.37	kJ/mol	Joback Calculated Property
ΔfusH°	40.21	kJ/mol	Joback Calculated Property
ΔvapH°	72.74	kJ/mol	Joback Calculated Property
log10WS	-4.59		Crippen Calculated Property
logPoct/wat	3.868		Crippen Calculated Property
McVol	238.520	ml/mol	McGowan Calculated Property
Pc	1636.45	kPa	Joback Calculated Property
Inp	[2106.00; 2106.00]
Inp	2106.00		NIST
Inp	2106.00		NIST
Tboil	785.08	K	Joback Calculated Property
Tc	978.67	K	Joback Calculated Property
Tfus	496.52	K	Joback Calculated Property
Vc	0.938	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[678.81; 736.22]	J/mol×K	[785.08; 978.67]
Cp,gas	678.81	J/mol×K	785.08	Joback Calculated Property
Cp,gas	690.55	J/mol×K	817.35	Joback Calculated Property
Cp,gas	701.40	J/mol×K	849.61	Joback Calculated Property
Cp,gas	711.38	J/mol×K	881.88	Joback Calculated Property
Cp,gas	720.50	J/mol×K	914.14	Joback Calculated Property
Cp,gas	728.77	J/mol×K	946.41	Joback Calculated Property
Cp,gas	736.22	J/mol×K	978.67	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,2,3,3-tetrafluoropropyl 4-chloro-2-methoxyphenyl ester.

Sources

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

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