Chemical Properties of Propane, 3,3-dichloro-1,1,1,2,2-pentafluoro- (CAS 422-56-0)

InChI

InChI=1S/C3HCl2F5/c4-1(5)2(6,7)3(8,9)10/h1H

InChI Key

COAUHYBSXMIJDK-UHFFFAOYSA-N

Formula

C3HCl2F5

SMILES

FC(F)(F)C(F)(F)C(Cl)Cl

Molecular Weight¹

202.94

CAS

422-56-0

Other Names

• 1,1-Dichloro-2,2,3,3,3-pentafluoropropane R225ca
• 1,1-dichloro-2,2,3,3,3-pentafluoropropane

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• 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

Cheméo can also estimate Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, 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	[133.69; 229.47]	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			5.77000e+00
Coefficient B			6.18900e-01
Coefficient C			-6.09000e-04
Coefficient D			2.13800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	133.69	J/mol×K	273.00	Calculated Property
Cp,gas	157.97	J/mol×K	353.78	Calculated Property
Cp,gas	177.26	J/mol×K	434.56	Calculated Property
Cp,gas	192.24	J/mol×K	515.33	Calculated Property
Cp,gas	203.58	J/mol×K	596.11	Calculated Property
Cp,gas	211.97	J/mol×K	676.89	Calculated Property
Cp,gas	218.08	J/mol×K	757.67	Calculated Property
Cp,gas	222.58	J/mol×K	838.44	Calculated Property
Cp,gas	226.15	J/mol×K	919.22	Calculated Property
Cp,gas	229.47	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Propane, 3,3-dichloro-1,1,1,2,2-pentafluoro-.

Sources

• Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
• PSRK revision IV (2005), critical constants and acentric factors of 1000 components ChEDL chemicals 1.5.2, from Horstmann, S.; Jabłoniec, A.; Krafczyk, J.; Fischer, K.; Gmehling, J. PSRK Group Contribution Equation of State: Comprehensive Revision and Extension IV, Including Critical Constants and α-Function Parameters for 1000 Components. Fluid Phase Equilib. 2005, 227, 157-164.
• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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