Chemical Properties of 2-Fluorobenzoic acid, 2,2,2-trichloroethyl ester

2-Fluorobenzoic acid, 2,2,2-trichloroethyl ester

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C9H6Cl3FO2/c10-9(11,12)5-15-8(14)6-3-1-2-4-7(6)13/h1-4H,5H2
InChI Key
YZKMLSAFLAZXDK-UHFFFAOYSA-N
Formula
C9H6Cl3FO2
SMILES
O=C(OCC(Cl)(Cl)Cl)c1ccccc1F
Molecular Weight1
271.50
Sources

Physical Properties

Property Value Unit Source
Δf -334.00 kJ/mol Joback Calculated Property
Δfgas -500.91 kJ/mol Joback Calculated Property
Δfus 23.76 kJ/mol Joback Calculated Property
Δvap 58.76 kJ/mol Joback Calculated Property
logPoct/wat 3.35 Crippen Calculated Property
Pc 2899.85 kPa Joback Calculated Property
Tboil 621.60 K Joback Calculated Property
Tc 853.91 K Joback Calculated Property
Tfus 395.06 K Joback Calculated Property
Vc 0.61 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 338.14 J/mol×K 621.6 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-Cl 3
=CH- (ring) 4
=C< (ring) 2
-CH2- 1
-F 1
>C< 1
>C=O (nonring) 1

Similar Compounds

2,4-Difluorobenzoic acid, 2,2,2-trichloroethyl ester. Ethyl 2-fluorobenzoate. Propyl 2-fluorobenzoate. 2,6-Difluorobenzoic acid, ethyl ester. 2-Fluorobenzoic acid, 3-methylbut-2-enyl ester. 2-Fluorobenzoic acid, butyl ester. 2-Fluorobenzoic acid, pent-2-en-4-ynyl ester. Methyl 2-fluorobenzoate. 3-Chloro-2-fluorobenzoic acid, 2,2,2-trichloroethyl ester. 2-Fluorobenzoic acid, 3-methylbutyl ester. 2,4-Difluorobenzoic acid, isopropyl ester. 2-Fluorobenzoic acid, undec-2-enyl ester. 2,6-Difluorobenzoic acid, 3-chloroprop-2-enyl ester. 2-Fluorobenzoic acid, 8-chlorooctyl ester. 2-Fluorobenzoic acid, 3-methylbut-2-yl ester.

Find more compounds similar to 2-Fluorobenzoic acid, 2,2,2-trichloroethyl ester.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.