Chemical Properties of Succinic acid, 2,2,3,3,4,4,4-heptafluorobutyl octyl ester

InChI

InChI=1S/C16H23F7O4/c1-2-3-4-5-6-7-10-26-12(24)8-9-13(25)27-11-14(17,18)15(19,20)16(21,22)23/h2-11H2,1H3

InChI Key

YVFXZPNCHRNERW-UHFFFAOYSA-N

Formula

C16H23F7O4

SMILES

CCCCCCCCOC(=O)CCC(=O)OCC(F)(F)C(F)(F)C(F)(F)F

Molecular Weight¹

412.34

• 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	-2400.12	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	45.25	kJ/mol	Joback Calculated Property
ΔvapH°	82.52	kJ/mol	Relay (1.0) Calculated Property
log10WS	-5.96		Relay (1.0) Calculated Property
logPoct/wat	5.046		Crippen Calculated Property
McVol	263.570	ml/mol	McGowan Calculated Property
Pc	1109.63	kPa	Joback Calculated Property
Inp	[1677.00; 1677.00]
Inp	1677.00		NIST
Inp	1677.00		NIST
Tboil	544.57	K	Relay (1.0) Calculated Property
Tc	658.78	K	Relay (1.0) Calculated Property
Tfus	251.42	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	[780.76; 857.60]	J/mol×K	[667.32; 824.35]
Cp,gas	780.76	J/mol×K	667.32	Joback Calculated Property
Cp,gas	795.58	J/mol×K	693.49	Joback Calculated Property
Cp,gas	809.55	J/mol×K	719.66	Joback Calculated Property
Cp,gas	822.71	J/mol×K	745.83	Joback Calculated Property
Cp,gas	835.08	J/mol×K	772.00	Joback Calculated Property
Cp,gas	846.70	J/mol×K	798.18	Joback Calculated Property
Cp,gas	857.60	J/mol×K	824.35	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2,2,3,3,4,4,4-heptafluorobutyl octyl 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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