Chemical Properties of 2,2-Dichloro-3,3,3-trifluoropropionic acid, n-propyl ester (CAS 357-49-3)

2,2-Dichloro-3,3,3-trifluoropropionic acid, n-propyl ester

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InChI
InChI=1S/C6H7Cl2F3O2/c1-2-3-13-4(12)5(7,8)6(9,10)11/h2-3H2,1H3
InChI Key
IIBBYIUDWCQOKV-UHFFFAOYSA-N
Formula
C6H7Cl2F3O2
SMILES
CCCOC(=O)C(Cl)(Cl)C(F)(F)F
Molecular Weight1
239.02
CAS
357-49-3
Sources

Physical Properties

Property Value Unit Source
Δf -836.89 kJ/mol Joback Calculated Property
Δfgas -1049.28 kJ/mol Joback Calculated Property
Δfus 16.89 kJ/mol Joback Calculated Property
Δvap 41.83 kJ/mol Joback Calculated Property
logPoct/wat 2.68 Crippen Calculated Property
Pc 2715.50 kPa Joback Calculated Property
Tboil 479.18 K Joback Calculated Property
Tc 663.79 K Joback Calculated Property
Tfus 295.99 K Joback Calculated Property
Vc 0.53 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 280.69 J/mol×K 479.18 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-F 3
-CH2- 2
-Cl 2
>C< 2
-CH3 1
>C=O (nonring) 1

Similar Compounds

Propionic acid, 2,2-dichloro-3,3,3-trifluoro-, n-butyl ester. 1,3-Propanediol bis(alpha,alpha-di-chloropropionate). Propanoic acid, 2,2-dichloro-, butyl ester. Propionic acid, 2,2-dichloro-, pentyl ester. Glycerine mono-alpha,alpha-dichloropropionate. 3-[(2,2-Dichloropropanoyl)oxy]-2,2-bis([(2,2-dichloropropanoyl)oxy]methyl)propyl 2,2-dichloropropanoate. 2-Hydroxyethyl alpha,alpha-dichloro propionate. 1,1,2-Trichloropropanoic anhydride. Isopropyl, a,a-dichloropropionate. Ethylene glycol bis(alpha,alpha-dichloropropionate). 2-[(2,2,3-Trichloropropanoyl)oxy]ethyl 2,2,3-trichloropropanoate. Diethylene glycol bis(2,2,3-trichloropropionate). 2,2,2-Trichloroethanol, pentafluoropropionate. Propionic acid, 2-chloro-, propyl ester. Propyl 2-chloropropionate.

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