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Thallium (I) acetate

CAT: 0024-sc-251221BSize: 100 gDry Ice: NoHazardous: No
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CAT#:0024-sc-251221BSize:100 g
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CAS Number
563-68-8

Chemical Information

thallium(I) acetate

Thallium(I) acetate is an acetate salt comprising equal numbers of acetate and thallium ions. It has a role as a neurotoxin and an apoptosis inducer. It is a thallium molecular entity and an acetate salt. It contains a thallium(1+).

CAS Number563-68-8
PubChem CID11247
IUPAC Namethallium(1+) acetate
Molecular FormulaC2H3O2Tl
Molecular Weight263.43
Topological Polar Surface Area40.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count5
Formal Charge0
Complexity25
SMILES
CC(=O)[O-].[Tl+]
InChI
InChI=1S/C2H4O2.Tl/c1-2(3)4;/h1H3,(H,3,4);/q;+1/p-1
InChIKey
HQOJMTATBXYHNR-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of thallium(I) acetate
CAS: 563-68-8
CID: 11247
Formula: C2H3O2Tl
MW: 263.43
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight263.43
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass263.98773
Monoisotopic Mass263.98773
Topological Polar Surface Area40.1 Ų
Heavy Atom Count5
Formal Charge0
Complexity25.5
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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