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Product No: AJ6156

Thallium(III) Trifluoroacetate, tech. gr.

Name: Thallium(III) Trifluoroacetate
Brand: Chempure

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CAS Number

23586-53-0

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IUPAC name	thallium(3+);2,2,2-trifluoroacetate
canonical smiles	C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-].[Tl+3]
inchi	InChI=1S/3C2HF3O2.Tl/c33-2(4,5)1(6)7;/h3(H,6,7);/q;;;+3/p-3
inchi key	PSHNNUKOUQCMSG-UHFFFAOYSA-K
molecular formula	C6F9O6Tl
synonyms	Thallium(III) trifluoroacetate 23586-53-0 Thallic trifluoroacetate 2,2,2-Trifluoroacetic acid, thallium(3+) salt (3:1) Trifluoroacetic acid thallium(III) salt

Computed Properties

Molecular Weight:	543.43 g/mol
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	15
Rotatable Bond Count:	0
Exact Mass:	543.92954 g/mol
Monoisotopic Mass:	543.92954 g/mol
Topological Polar Surface Area:	120 Å²
Heavy Atom Count:	22
Formal Charge:	0
Complexity:	77.9
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	4
Compound Is Canonicalized:	Yes

Related Compounds

Thallium(III) trifluoroacetate

Mercury bis(trifluoroacetate)

Bis(trifluoroacetyl) peroxide

Copper (II) Trifluoroacetate

Palladium(II) trifluoroacetate

Nickel(2+) trifluoroacetate

Hg(TFA)2

Trifluoroacetic acid thallium(iii)salt

Bi(tfa)3

Barium bis(trifluoroacetate)

Antimon-tris(trifluoracetat)

Bis[(2,2,2-trifluoroacetyl)oxy]lead

ZINC trifluoroacetate

[Bis(trifluoroacetyloxy)iodine]

Magnesium 2,2,2-trifluoroacetate

hazard signal	Danger
hazard classes and categories	Acute Tox. 2 (100%) STOT RE 2 (100%) Aquatic Chronic 2 (100%)
precautionary statement codes	P260, P264, P270, P271, P273, P284, P301+P316, P304+P340, P316, P319, P320, P321, P330, P391, P403+P233, P405, and P501
hazard statements	H300 (100%): Fatal if swallowed [Danger Acute toxicity, oral] H330 (100%): Fatal if inhaled [Danger Acute toxicity, inhalation] H373 (100%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure] H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
hazards summary	An irritant. Highly toxic by ingestion and inhalation. See Sodium fluoroacetate. See Thallium and the linked occupational disease.

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Documentation

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*This document is like a lab demo—an example Certificate of Analysis (COA) that showcases what a COA looks like but may not match the latest batch in all its glory. Think of it as a chemistry experiment: close, but not quite the final reaction!

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About this item

IUPAC name	thallium(3+);2,2,2-trifluoroacetate
canonical smiles	C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-].[Tl+3]
inchi	InChI=1S/3C2HF3O2.Tl/c33-2(4,5)1(6)7;/h3(H,6,7);/q;;;+3/p-3
inchi key	PSHNNUKOUQCMSG-UHFFFAOYSA-K
molecular formula	C6F9O6Tl
synonyms	Thallium(III) trifluoroacetate 23586-53-0 Thallic trifluoroacetate 2,2,2-Trifluoroacetic acid, thallium(3+) salt (3:1) Trifluoroacetic acid thallium(III) salt

Computed Properties

Molecular Weight:	543.43 g/mol
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	15
Rotatable Bond Count:	0
Exact Mass:	543.92954 g/mol
Monoisotopic Mass:	543.92954 g/mol
Topological Polar Surface Area:	120 Å²
Heavy Atom Count:	22
Formal Charge:	0
Complexity:	77.9
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	4
Compound Is Canonicalized:	Yes

Related Compounds

Thallium(III) trifluoroacetate

Mercury bis(trifluoroacetate)

Bis(trifluoroacetyl) peroxide

Copper (II) Trifluoroacetate

Palladium(II) trifluoroacetate

Nickel(2+) trifluoroacetate

Hg(TFA)2

Trifluoroacetic acid thallium(iii)salt

Bi(tfa)3

Barium bis(trifluoroacetate)

Antimon-tris(trifluoracetat)

Bis[(2,2,2-trifluoroacetyl)oxy]lead

ZINC trifluoroacetate

[Bis(trifluoroacetyloxy)iodine]

Magnesium 2,2,2-trifluoroacetate

hazard signal	Danger
hazard classes and categories	Acute Tox. 2 (100%) STOT RE 2 (100%) Aquatic Chronic 2 (100%)
precautionary statement codes	P260, P264, P270, P271, P273, P284, P301+P316, P304+P340, P316, P319, P320, P321, P330, P391, P403+P233, P405, and P501
hazard statements	H300 (100%): Fatal if swallowed [Danger Acute toxicity, oral] H330 (100%): Fatal if inhaled [Danger Acute toxicity, inhalation] H373 (100%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure] H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
hazards summary	An irritant. Highly toxic by ingestion and inhalation. See Sodium fluoroacetate. See Thallium and the linked occupational disease.

Product No: AJ6156

Thallium(III) Trifluoroacetate, tech. gr.

Product No: AJ6156

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

About this item

Documentation

Certificate of Analysis

Require a Sample Certificate of Analysis (COA) ?

Reviews

Product No: AJ6156

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?