Chemical Properties of Glutaric acid, 1-(2,6-difluorophenyl)ethyl pentadecyl ester

InChI

InChI=1S/C28H44F2O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-22-33-26(31)20-17-21-27(32)34-23(2)28-24(29)18-16-19-25(28)30/h16,18-19,23H,3-15,17,20-22H2,1-2H3

InChI Key

HJGJDJMBLISUER-UHFFFAOYSA-N

Formula

C28H44F2O4

SMILES

CCCCCCCCCCCCCCCOC(=O)CCCC(=O)OC(C)c1c(F)cccc1F

Molecular Weight¹

482.64

• 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°	-581.87	kJ/mol	Joback Calculated Property
ΔfH°gas	-1294.76	kJ/mol	Joback Calculated Property
ΔfusH°	69.75	kJ/mol	Joback Calculated Property
ΔvapH°	97.81	kJ/mol	Joback Calculated Property
log10WS	-9.49		Crippen Calculated Property
logPoct/wat	8.374		Crippen Calculated Property
McVol	400.040	ml/mol	McGowan Calculated Property
Pc	773.75	kPa	Joback Calculated Property
Inp	[3203.00; 3203.00]
Inp	3203.00		NIST
Inp	3203.00		NIST
Tboil	1027.36	K	Joback Calculated Property
Tc	1268.40	K	Joback Calculated Property
Tfus	587.28	K	Joback Calculated Property
Vc	1.573	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1382.44; 1463.63]	J/mol×K	[1027.36; 1268.40]
Cp,gas	1382.44	J/mol×K	1027.36	Joback Calculated Property
Cp,gas	1400.54	J/mol×K	1067.53	Joback Calculated Property
Cp,gas	1416.71	J/mol×K	1107.71	Joback Calculated Property
Cp,gas	1431.04	J/mol×K	1147.88	Joback Calculated Property
Cp,gas	1443.59	J/mol×K	1188.05	Joback Calculated Property
Cp,gas	1454.43	J/mol×K	1228.22	Joback Calculated Property
Cp,gas	1463.63	J/mol×K	1268.40	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 1-(2,6-difluorophenyl)ethyl pentadecyl ester.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.