Chemical Properties of Succinic acid, but-3-yn-2-yl 2-fluoro-3-(trifluoromethyl)phenyl ester

Succinic acid, but-3-yn-2-yl 2-fluoro-3-(trifluoromethyl)phenyl ester

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InChI
InChI=1S/C15H12F4O4/c1-3-9(2)22-12(20)7-8-13(21)23-11-6-4-5-10(14(11)16)15(17,18)19/h1,4-6,9H,7-8H2,2H3
InChI Key
DFWZTBXBZXFMEI-UHFFFAOYSA-N
Formula
C15H12F4O4
SMILES
C#CC(C)OC(=O)CCC(=O)Oc1cccc(C(F)(F)F)c1F
Molecular Weight1
332.25
Sources

Physical Properties

Property Value Unit Source
Δf -855.04 kJ/mol Joback Calculated Property
Δfgas -1135.51 kJ/mol Joback Calculated Property
Δfus 37.80 kJ/mol Joback Calculated Property
Δvap 65.80 kJ/mol Joback Calculated Property
logPoct/wat 3.10 Crippen Calculated Property
Pc 1940.65 kPa Joback Calculated Property
Tboil 715.35 K Joback Calculated Property
Tc 912.51 K Joback Calculated Property
Tfus 491.34 K Joback Calculated Property
Vc 0.83 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 578.15 J/mol×K 715.35 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
-F 4
=CH- (ring) 3
#C- 1
=C< (ring) 3
-CH2- 2
>C< 1
#CH 1
-CH3 1
>C=O (nonring) 2

Similar Compounds

Succinic acid, tridec-2-yn-1-yl 2-fluoro-3-(trifluoromethyl)phenyl ester. Succinic acid, 8-chlorooctyl 2-fluoro-3-(trifluoromethyl)phenyl ester. Glutaric acid, but-3-yn-2-yl 2-fluoro-3-trifluoromethylphenyl ester. Succinic acid, cyclohexylmethyl 2-fluoro-3-(trifluoromethyl)phenyl ester. Glutaric acid, hex-4-yn-3-yl 2-fluoro-3-trifluoromethylphenyl ester. Glutaric acid, tridec-2-yn-1-yl 2-fluoro-3-trifluoromethylphenyl ester. Glutaric acid, 3-methylbut-2-en-1-yl 2-fluoro-3-trifluoromethylphenyl ester. 2-Ethylbutyric acid, 2-fluoro-3-trifluoromethylphenyl ester. Glutaric acid, dodec-2-en-1-yl 2-fluoro-3-trifluoromethylphenyl ester. Succinic acid, 2-naphthylmethyl 2-fluoro-3-(trifluoromethyl)phenyl ester. Glutaric acid, cyclohexylmethyl 2-fluoro-3-trifluoromethylphenyl ester. Succinic acid, 2,4,6-trichlorophenyl 2-fluoro-3-(trifluoromethyl)phenyl ester. Diethylmalonic acid, di(2-fluoro-3-trifluoromethylphenyl) ester. Dimethylmalonic acid, 2-fluoro-3-trifluoromethylphenyl pentyl ester. Glutaric acid, 2,4,6-trichlorophenyl 2-fluoro-3-trifluoromethylphenyl ester.

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