Chemical Properties of 2,6-Difluorobenzoic acid, but-3-yn-2-yl ester

2,6-Difluorobenzoic acid, but-3-yn-2-yl ester

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InChI
InChI=1S/C11H8F2O2/c1-3-7(2)15-11(14)10-8(12)5-4-6-9(10)13/h1,4-7H,2H3
InChI Key
GDWZNZBLLTYAED-UHFFFAOYSA-N
Formula
C11H8F2O2
SMILES
C#CC(C)OC(=O)c1c(F)cccc1F
Molecular Weight1
210.18
Sources

Physical Properties

Property Value Unit Source
Δf -268.02 kJ/mol Joback Calculated Property
Δfgas -407.18 kJ/mol Joback Calculated Property
Δfus 25.91 kJ/mol Joback Calculated Property
Δvap 50.67 kJ/mol Joback Calculated Property
logPoct/wat 2.14 Crippen Calculated Property
Pc 2887.40 kPa Joback Calculated Property
Tboil 552.23 K Joback Calculated Property
Tc 761.57 K Joback Calculated Property
Tfus 370.50 K Joback Calculated Property
Vc 0.56 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 324.87 J/mol×K 552.23 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 1
-F 2
=CH- (ring) 3
#C- 1
=C< (ring) 3
#CH 1
>C=O (nonring) 1
-CH3 1

Similar Compounds

2,6-Difluorobenzoic acid, ethyl ester. 2,6-Difluorobenzoic acid, hex-4-yn-3-yl ester. 2,6-difluorobenzoic acid, tridec-2-ynyl ester. 2,4-Difluorobenzoic acid, isopropyl ester. 2,6-Difluorobenzoic acid, pent-2-en-4-ynyl ester. 2,6-Difluorobenzoic acid, 3-chloroprop-2-enyl ester. 2,6-difluorobenzoic acid, 3-methylbut-2-enyl ester. 2,6-Difluorobenzoic acid, oct-3-en-2-yl ester. 2,6-Difluorobenzoic acid, hexyl ester. 2,3,4-Trifluorobenzoic acid, but-3-yn-2-yl ester. 2-Fluorobenzoic acid, hex-4-yn-3-yl ester. 2,6-Difluorobenzoic acid, heptyl ester. 2,6-Difluorobenzoic acid,2-tetradecyl ester. 2,6-Difluorobenzoic acid, hexadecyl ester. 2,6-Difluorobenzoic acid, octadecyl ester.

Find more compounds similar to 2,6-Difluorobenzoic acid, but-3-yn-2-yl ester.

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