Chemical Properties of Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentadecyl ester

InChI

InChI=1S/C25H40F8O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-36-20(34)16-15-17-21(35)37-19-23(28,29)25(32,33)24(30,31)22(26)27/h22H,2-19H2,1H3

InChI Key

BATNODXYURFQMQ-UHFFFAOYSA-N

Formula

C25H40F8O4

SMILES

CCCCCCCCCCCCCCCOC(=O)CCCC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F

Molecular Weight¹

556.57

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-2717.14	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	68.12	kJ/mol	Joback Calculated Property
ΔvapH°	119.31	kJ/mol	Relay (1.0) Calculated Property
log10WS	-8.42		Relay (1.0) Calculated Property
logPoct/wat	8.505		Crippen Calculated Property
McVol	392.150	ml/mol	McGowan Calculated Property
Pc	656.45	kPa	Joback Calculated Property
Inp	[2653.00; 2653.00]
Inp	2653.00		NIST
Inp	2653.00		NIST
Tboil	653.23	K	Relay (1.0) Calculated Property
Tc	778.03	K	Relay (1.0) Calculated Property
Tfus	315.71	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1320.21; 1419.50]	J/mol×K	[872.07; 1079.16]
Cp,gas	1320.21	J/mol×K	872.07	Joback Calculated Property
Cp,gas	1340.11	J/mol×K	906.58	Joback Calculated Property
Cp,gas	1358.52	J/mol×K	941.10	Joback Calculated Property
Cp,gas	1375.56	J/mol×K	975.61	Joback Calculated Property
Cp,gas	1391.33	J/mol×K	1010.13	Joback Calculated Property
Cp,gas	1405.94	J/mol×K	1044.64	Joback Calculated Property
Cp,gas	1419.50	J/mol×K	1079.16	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentadecyl ester.

Sources

• Cheméo Relay (1.0)
• 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.
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