Chemical Properties of Succinic acid, 1,1,1-trifluoroprop-2-yl 2,4-dichloronaphth-1-yl ester

InChI

InChI=1S/C17H13Cl2F3O4/c1-9(17(20,21)22)25-14(23)6-7-15(24)26-16-11-5-3-2-4-10(11)12(18)8-13(16)19/h2-5,8-9H,6-7H2,1H3

InChI Key

UNJFRBDUXLOQBS-UHFFFAOYSA-N

Formula

C17H13Cl2F3O4

SMILES

CC(OC(=O)CCC(=O)Oc1c(Cl)cc(Cl)c2ccccc12)C(F)(F)F

Molecular Weight¹

409.18

• 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°	-793.30	kJ/mol	Joback Calculated Property
ΔfH°gas	-1124.46	kJ/mol	Joback Calculated Property
ΔfusH°	41.95	kJ/mol	Joback Calculated Property
ΔvapH°	82.28	kJ/mol	Joback Calculated Property
log10WS	-6.69		Crippen Calculated Property
logPoct/wat	5.326		Crippen Calculated Property
McVol	251.840	ml/mol	McGowan Calculated Property
Pc	1723.16	kPa	Joback Calculated Property
Inp	[2421.00; 2421.00]
Inp	2421.00		NIST
Inp	2421.00		NIST
Tboil	870.54	K	Joback Calculated Property
Tc	1088.69	K	Joback Calculated Property
Tfus	571.38	K	Joback Calculated Property
Vc	0.985	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[700.12; 749.73]	J/mol×K	[870.54; 1088.69]
Cp,gas	700.12	J/mol×K	870.54	Joback Calculated Property
Cp,gas	710.35	J/mol×K	906.90	Joback Calculated Property
Cp,gas	719.71	J/mol×K	943.26	Joback Calculated Property
Cp,gas	728.27	J/mol×K	979.62	Joback Calculated Property
Cp,gas	736.09	J/mol×K	1015.98	Joback Calculated Property
Cp,gas	743.22	J/mol×K	1052.33	Joback Calculated Property
Cp,gas	749.73	J/mol×K	1088.69	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 1,1,1-trifluoroprop-2-yl 2,4-dichloronaphth-1-yl ester.

Sources

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

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