Chemical Properties of Succinic acid, 1,1,1-trifluoroprop-2-yl diphenylmethyl ester

InChI

InChI=1S/C20H19F3O4/c1-14(20(21,22)23)26-17(24)12-13-18(25)27-19(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-11,14,19H,12-13H2,1H3

InChI Key

HVRXSILVVGKWHK-UHFFFAOYSA-N

Formula

C20H19F3O4

SMILES

CC(OC(=O)CCC(=O)OC(c1ccccc1)c1ccccc1)C(F)(F)F

Molecular Weight¹

380.36

• 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°	-711.97	kJ/mol	Joback Calculated Property
ΔfH°gas	-1080.31	kJ/mol	Joback Calculated Property
ΔfusH°	35.99	kJ/mol	Joback Calculated Property
ΔvapH°	78.46	kJ/mol	Joback Calculated Property
log10WS	-5.46		Crippen Calculated Property
logPoct/wat	4.593		Crippen Calculated Property
McVol	265.330	ml/mol	McGowan Calculated Property
Pc	1620.68	kPa	Joback Calculated Property
Inp	[2180.00; 2180.00]
Inp	2180.00		NIST
Inp	2180.00		NIST
Tboil	856.64	K	Joback Calculated Property
Tc	1073.66	K	Joback Calculated Property
Tfus	486.51	K	Joback Calculated Property
Vc	1.018	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[806.96; 870.13]	J/mol×K	[856.64; 1073.66]
Cp,gas	806.96	J/mol×K	856.64	Joback Calculated Property
Cp,gas	820.26	J/mol×K	892.81	Joback Calculated Property
Cp,gas	832.36	J/mol×K	928.98	Joback Calculated Property
Cp,gas	843.33	J/mol×K	965.15	Joback Calculated Property
Cp,gas	853.23	J/mol×K	1001.32	Joback Calculated Property
Cp,gas	862.15	J/mol×K	1037.49	Joback Calculated Property
Cp,gas	870.13	J/mol×K	1073.66	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 1,1,1-trifluoroprop-2-yl diphenylmethyl ester.

Sources

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

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