Chemical Properties of Carbonfluoridodithioic acid, trifluoromethyl ester (CAS 371-73-3)

InChI

InChI=1S/C2F4S2/c3-1(7)8-2(4,5)6

InChI Key

HPCKLTYHXIHJPW-UHFFFAOYSA-N

Formula

C2F4S2

SMILES

FC(=S)SC(F)(F)F

Molecular Weight¹

164.15

CAS

371-73-3

Other Names

• Trifluoromethyl fluorodithioformate

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[107.89; 173.75]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			1.29700e+01
Coefficient B			4.68580e-01
Coefficient C			-4.93600e-04
Coefficient D			1.85800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	107.89	J/mol×K	273.00	Calculated Property
Cp,gas	125.19	J/mol×K	353.78	Calculated Property
Cp,gas	138.63	J/mol×K	434.56	Calculated Property
Cp,gas	148.79	J/mol×K	515.33	Calculated Property
Cp,gas	156.25	J/mol×K	596.11	Calculated Property
Cp,gas	161.61	J/mol×K	676.89	Calculated Property
Cp,gas	165.45	J/mol×K	757.67	Calculated Property
Cp,gas	168.37	J/mol×K	838.44	Calculated Property
Cp,gas	170.94	J/mol×K	919.22	Calculated Property
Cp,gas	173.75	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Carbonfluoridodithioic acid, trifluoromethyl ester.

Sources

• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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