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

InChI

InChI=1S/C15H21F7O4/c1-4-5-10(9(2)3)26-12(24)7-6-11(23)25-8-13(16,17)14(18,19)15(20,21)22/h9-10H,4-8H2,1-3H3

InChI Key

IAWYKDRFTPIBSU-UHFFFAOYSA-N

Formula

C15H21F7O4

SMILES

CCCC(OC(=O)CCC(=O)OCC(F)(F)C(F)(F)C(F)(F)F)C(C)C

Molecular Weight¹

398.31

• 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°	-1752.45	kJ/mol	Joback Calculated Property
ΔfH°gas	-2252.11	kJ/mol	Joback Calculated Property
ΔfusH°	32.45	kJ/mol	Joback Calculated Property
ΔvapH°	56.91	kJ/mol	Joback Calculated Property
log10WS	-4.99		Crippen Calculated Property
logPoct/wat	4.511		Crippen Calculated Property
McVol	249.480	ml/mol	McGowan Calculated Property
Pc	1268.25	kPa	Joback Calculated Property
Inp	[1461.00; 1461.00]
Inp	1461.00		NIST
Inp	1461.00		NIST
Tboil	679.50	K	Joback Calculated Property
Tc	843.39	K	Joback Calculated Property
Tfus	384.52	K	Joback Calculated Property
Vc	1.004	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[740.54; 814.27]	J/mol×K	[679.50; 843.39]
Cp,gas	740.54	J/mol×K	679.50	Joback Calculated Property
Cp,gas	754.75	J/mol×K	706.82	Joback Calculated Property
Cp,gas	768.14	J/mol×K	734.13	Joback Calculated Property
Cp,gas	780.75	J/mol×K	761.45	Joback Calculated Property
Cp,gas	792.62	J/mol×K	788.76	Joback Calculated Property
Cp,gas	803.78	J/mol×K	816.08	Joback Calculated Property
Cp,gas	814.27	J/mol×K	843.39	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2,2,3,3,4,4,4-heptafluorobutyl 2-methylhex-3-yl ester.

Sources

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

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