Thallium(III) trifluoroacetate

C6F9O6TlCAS 23586-53-0543.43 g/mol

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O−OFFFO−OFFFO−OFFFTl3+
Alkyl halideCarboxylic acid

Properties

Molecular formula
C6F9O6Tl
Molar mass
543.43 g/mol
Exact mass
543.9295 Da
logP
0.25Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
23586-53-0
SMILES
[O-]C(=O)C(F)(F)F.[O-]C(=O)C(F)(F)F.[O-]C(=O)C(F)(F)F.[Tl+3]
InChI

The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.

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Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names
  • Acetic acid, 2,2,2-trifluoro-, thallium(3+) salt (3:1)
  • Acetic acid, trifluoro-, thallium(3+) salt
  • Thallium tris(trifluoroacetate)
  • Tris(trifluoroacetato)thallium
  • Thallic trifluoroacetate

Work with Thallium(III) trifluoroacetate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Trifluoroacetic acid76-05-1Free acid Trifluoroacetic acid-d599-00-8Free acid, labelled Sodium trifluoroacetate2923-18-4Salt Silver trifluoroacetate2966-50-9Salt Mercuric trifluoroacetate13257-51-7Salt Lithium trifluoroacetate2923-17-3Salt N-Methylanilinium trifluoroacetate29885-95-8Salt Pyridinium trifluoroacetate464-05-1Salt Potassium trifluoroacetate2923-16-2Salt Copper(II) trifluoroacetate hydrate123333-88-0Salt LL-37 (human) trifluoroacetate salt597562-32-8Salt 1-(4-Fluoro-benzyl)-piperazine trifluoroacetate435345-45-2Salt

Similar compounds

Palladium(II) trifluoroacetate42196-31-671 % similar Sodium chlorodifluoroacetate1895-39-239 % similar Sodium pentafluoropropionate378-77-839 % similar Hexafluoroacetone684-16-236 % similar Sodium heptafluorobutyrate2218-54-435 % similar Silver heptafluorobutyrate3794-64-735 % similar Zinc 2,2-dimethylpropanoate15827-10-833 % similar Perfluorooctanoic acid sodium salt335-95-533 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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