Chemical Properties of Benzene, 1-chloro-4-(1-chloro-2,2,2-trifluoroethyl)

Benzene, 1-chloro-4-(1-chloro-2,2,2-trifluoroethyl)

InChI
InChI=1S/C8H5Cl2F3/c9-6-3-1-5(2-4-6)7(10)8(11,12)13/h1-4,7H
InChI Key
AQHYRPGOKQLFEB-UHFFFAOYSA-N
Formula
C8H5Cl2F3
SMILES
FC(F)(F)C(Cl)c1ccc(Cl)cc1
Molecular Weight1
229.03
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Physical Properties

Property Value Unit Source
ΔfH°gas -668.44 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 16.82 kJ/mol Joback Calculated Property
ΔvapH° 52.24 kJ/mol Relay (1.0) Calculated Property
IE 9.54 eV Relay (1.0) Calculated Property
log10WS -3.77 Relay (1.0) Calculated Property
logPoct/wat 4.182 Crippen Calculated Property
McVol 129.610 ml/mol McGowan Calculated Property
Inp [1025.00; 1025.00]   Show Hide
Inp 1025.00 NIST
Inp 1025.00 NIST
Tboil 452.41 K Relay (1.0) Calculated Property
Tfus 279.01 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor 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 [170.12; 350.25] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-6.09000e+00
Coefficient B8.06100e-01
Coefficient C-6.40560e-04
Coefficient D1.90800e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 170.12 J/mol×K 273.00 Calculated Property
Cp,gas 207.37 J/mol×K 353.78 Calculated Property
Cp,gas 238.90 J/mol×K 434.56 Calculated Property
Cp,gas 265.32 J/mol×K 515.33 Calculated Property
Cp,gas 287.23 J/mol×K 596.11 Calculated Property
Cp,gas 305.23 J/mol×K 676.89 Calculated Property
Cp,gas 319.93 J/mol×K 757.67 Calculated Property
Cp,gas 331.93 J/mol×K 838.44 Calculated Property
Cp,gas 341.84 J/mol×K 919.22 Calculated Property
Cp,gas 350.25 J/mol×K 1000.00 Calculated Property

Similar Compounds

Benzene, 1-chloro-4-(1-chloro-2,2-difluoroethyl). Benzene, (1-chloro-2,2,2-trifluoroethyl). Benzene, 1-chloro-3-(1-chloro-2,2,2-trifluoroethyl). Benzene, 1-fluoro-4-(1-chloro-2,2,2-trifluoroethyl). Benzene, 1-methoxy-4-(1-chloro-2,2,2-trifluoroethyl). Benzene, (1-chloro-2-fluoroethyl). Benzene, 1-chloro-4-(1-bromo-2,2,2-trifluoroethyl). Benzeneethanol, 2,2,2-trifluoro-1-(4-chlorophenyl). 1,2-bis-(4-Chlorophenyl)-1-chloroethane. Benzene, 1-chloro-3-(2,2,2-trifluoroethyl). Benzene, 1-chloro-4-(2-fluoroethyl). Benzeneethanol, 2,2-difluoro-1-(4-chlorophenyl). Benzene, (1-chloroethyl)-. Benzeneacetonitrile, 4-chloro-. Benzene, 1-(1-chloroethyl)-4-(chloromethyl)-.

Find more compounds similar to Benzene, 1-chloro-4-(1-chloro-2,2,2-trifluoroethyl).

Sources

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