Chemical Properties of 2,3,5-Trichlorophenol, O-trifluoroacetyl-

2,3,5-Trichlorophenol, O-trifluoroacetyl-

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InChI
InChI=1S/C8H2Cl3F3O2/c9-3-1-4(10)6(11)5(2-3)16-7(15)8(12,13)14/h1-2H
InChI Key
VRHGAJDZCAFIGN-UHFFFAOYSA-N
Formula
C8H2Cl3F3O2
SMILES
O=C(Oc1cc(Cl)cc(Cl)c1Cl)C(F)(F)F
Molecular Weight1
293.45
Sources

Physical Properties

Property Value Unit Source
Δf -751.30 kJ/mol Joback Calculated Property
Δfgas -895.43 kJ/mol Joback Calculated Property
Δfus 26.55 kJ/mol Joback Calculated Property
Δvap 56.23 kJ/mol Joback Calculated Property
logPoct/wat 4.11 Crippen Calculated Property
Pc 2826.33 kPa Joback Calculated Property
Tboil 607.22 K Joback Calculated Property
Tc 823.97 K Joback Calculated Property
Tfus 410.01 K Joback Calculated Property
Vc 0.59 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 306.46 J/mol×K 607.22 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-Cl 3
=CH- (ring) 2
=C< (ring) 4
-F 3
>C< 1
>C=O (nonring) 1

Similar Compounds

Pentachlorophenol, O-trifluoroacetyl-. Phenol, 2,3,5,6-tetrachloro-, acetate. Phenol, 2,3,6-trichloro-, acetate. Phenol, 2,3,4,5-tetrachloro-, acetate. 2,3,4,6-Tetrachlorophenyl acetate. Pentachlorophenyl acetate. Phenol, 2,4,5-trichloro-, acetate. Phenol, 2,3-dichloro-, acetate. Phenol, 2,3,4-trichloro-, acetate. Chloroacetic acid, 2,3,4,6-tetrachlorophenyl ester. Succinic acid, di(2,3,5-trichlorophenyl) ester. 2-Ethylbutyric acid, 2,3,5-trichlorophenyl ester. Succinic acid, di(2,3,5,6-tetrachlorophenyl) ester. Chloroacetic acid, 2,4,5-trichlorophenyl ester. Fumaric acid, di(2,3,6-trichlorophenyl) ester.

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