Chemical Properties of Ethane, 2-chloro-1-(chloromethoxy)-1,1,2-trifluoro- (CAS 428-92-2)

InChI

InChI=1S/C3H3Cl2F3O/c4-1-9-3(7,8)2(5)6/h2H,1H2

InChI Key

FAERCLVMZOAFPK-UHFFFAOYSA-N

Formula

C3H3Cl2F3O

SMILES

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

Molecular Weight¹

182.96

CAS

428-92-2

Other Names

• Ether, chloromethyl 2-chloro-1,1,2-trifluoroethyl
• Chloromethyl 2-chloro-1,1,2-trifluoroethyl ether
• 2-chloro-1-(chloromethoxy)-1,1,2-trifluoroethane
• 2-Chloro-1,1,2-trifluoroethyl chloromethyl ether

• 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).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, Critical Volume, Enthalpy of formation 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
ΔvapH	[37.80; 41.20]	kJ/mol	[313.00; 358.00]
ΔvapH	41.20 ± 0.10	kJ/mol	313.00	NIST
ΔvapH	40.10 ± 0.10	kJ/mol	328.00	NIST
ΔvapH	39.00 ± 0.10	kJ/mol	343.00	NIST
ΔvapH	37.80 ± 0.10	kJ/mol	358.00	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[134.16; 232.36]	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			4.35610e+01
Coefficient B			4.06300e-01
Coefficient C			-2.93400e-04
Coefficient D			7.59000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	134.16	J/mol×K	273.00	Calculated Property
Cp,gas	153.94	J/mol×K	353.78	Calculated Property
Cp,gas	170.94	J/mol×K	434.56	Calculated Property
Cp,gas	185.41	J/mol×K	515.33	Calculated Property
Cp,gas	197.58	J/mol×K	596.11	Calculated Property
Cp,gas	207.69	J/mol×K	676.89	Calculated Property
Cp,gas	215.98	J/mol×K	757.67	Calculated Property
Cp,gas	222.70	J/mol×K	838.44	Calculated Property
Cp,gas	228.08	J/mol×K	919.22	Calculated Property
Cp,gas	232.36	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Ethane, 2-chloro-1-(chloromethoxy)-1,1,2-trifluoro-.

Sources

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

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