Chemical Properties of Succinic acid, di(1-bromo-3,3,3-trifluoroprop-2-yl) ester

InChI

InChI=1S/C10H10Br2F6O4/c11-3-5(9(13,14)15)21-7(19)1-2-8(20)22-6(4-12)10(16,17)18/h5-6H,1-4H2

InChI Key

OGWDGPASDQINOK-UHFFFAOYSA-N

Formula

C10H10Br2F6O4

SMILES

O=C(CCC(=O)OC(CBr)C(F)(F)F)OC(CBr)C(F)(F)F

Molecular Weight¹

467.98

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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
ω	0.7811		Relay (... Calculated Property
ΔfG°	-1573.94	kJ/mol	Joback Calculated Property
ΔfH°gas	-2108.41	kJ/mol	Relay (... Calculated Property
ΔfusH°	34.41	kJ/mol	Joback Calculated Property
ΔvapH°	82.11	kJ/mol	Relay (... Calculated Property
IE	10.82	eV	Relay (... Calculated Property
log10WS	-4.64		Relay (... Calculated Property
logPoct/wat	3.505		Crippen Calculated Property
McVol	212.260	ml/mol	McGowan Calculated Property
Pc	2135.43	kPa	Joback Calculated Property
Inp	[1528.00; 1528.00]
Inp	1528.00		NIST
Inp	1528.00		NIST
Tboil	530.49	K	Relay (... Calculated Property
Tc	689.70	K	Relay (... Calculated Property
Tfus	354.57	K	Relay (... Calculated Property
Vc	0.741	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[547.57; 594.81]	J/mol×K	[701.38; 885.72]
Cp,gas	547.57	J/mol×K	701.38	Joback Calculated Property
Cp,gas	557.01	J/mol×K	732.10	Joback Calculated Property
Cp,gas	565.76	J/mol×K	762.83	Joback Calculated Property
Cp,gas	573.88	J/mol×K	793.55	Joback Calculated Property
Cp,gas	581.40	J/mol×K	824.27	Joback Calculated Property
Cp,gas	588.37	J/mol×K	855.00	Joback Calculated Property
Cp,gas	594.81	J/mol×K	885.72	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, di(1-bromo-3,3,3-trifluoroprop-2-yl) ester.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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