Chemical Properties of Succinic acid, 2-chloro-6-fluorophenyl tetrahydrofurfuryl ester

InChI

InChI=1S/C15H16ClFO5/c16-11-4-1-5-12(17)15(11)22-14(19)7-6-13(18)21-9-10-3-2-8-20-10/h1,4-5,10H,2-3,6-9H2

InChI Key

XALIYFWWLKGVLV-UHFFFAOYSA-N

Formula

C15H16ClFO5

SMILES

O=C(CCC(=O)Oc1c(F)cccc1Cl)OCC1CCCO1

Molecular Weight¹

330.74

• 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°	-555.58	kJ/mol	Joback Calculated Property
ΔfH°gas	-912.31	kJ/mol	Joback Calculated Property
ΔfusH°	42.63	kJ/mol	Joback Calculated Property
ΔvapH°	79.23	kJ/mol	Joback Calculated Property
log10WS	-3.69		Crippen Calculated Property
logPoct/wat	2.887		Crippen Calculated Property
McVol	222.350	ml/mol	McGowan Calculated Property
Pc	2111.94	kPa	Joback Calculated Property
Inp	[2347.00; 2347.00]
Inp	2347.00		NIST
Inp	2347.00		NIST
Tboil	810.75	K	Joback Calculated Property
Tc	1031.30	K	Joback Calculated Property
Tfus	522.57	K	Joback Calculated Property
Vc	0.845	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[645.95; 708.20]	J/mol×K	[810.75; 1031.30]
Cp,gas	645.95	J/mol×K	810.75	Joback Calculated Property
Cp,gas	659.14	J/mol×K	847.51	Joback Calculated Property
Cp,gas	671.18	J/mol×K	884.27	Joback Calculated Property
Cp,gas	682.09	J/mol×K	921.02	Joback Calculated Property
Cp,gas	691.89	J/mol×K	957.78	Joback Calculated Property
Cp,gas	700.58	J/mol×K	994.54	Joback Calculated Property
Cp,gas	708.20	J/mol×K	1031.30	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2-chloro-6-fluorophenyl tetrahydrofurfuryl ester.

Sources

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

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