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Mercuric Trifluoroacetate

CAT: 0572-TRC-T786030-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-T786030-1GSize:1 g
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CAS Number
13257-51-7
Synonyms
Bis(trifluoroacetato)mercury; Bis(trifluoroacetoxy)mercury; Mercury Bis(trifluoroacetate); Mercury(2+) Trifluoroacetate; Mercury(II) Bis(trifluoroacetate); Mercury(II) Trifluoroacetate; Trifluoroacetic Acid Mercury(2+) Salt;
Hazard Statement
Fatal if swallowed; UN number: UN2025; Packing Group: I
Smiles
[Hg].OC(=O)C(F)(F)F.OC(=O)C(F)(F)F
Molecular Formula
2(C2HF3O2) . Hg
Shipping Conditions
Room Temperature

Chemical Information

Mercury bis(trifluoroacetate)
CAS Number13257-51-7
PubChem CID2723924
IUPAC Namemercury(2+);bis(2,2,2-trifluoroacetate)
Molecular FormulaC4F6HgO4
Molecular Weight426.62
Topological Polar Surface Area80.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count10
Rotatable Bond Count0
Heavy Atom Count15
Formal Charge0
Complexity77
SMILES
C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-].[Hg+2]
InChI
InChI=1S/2C2HF3O2.Hg/c2*3-2(4,5)1(6)7;/h2*(H,6,7);/q;;+2/p-2
InChIKey
WMHOESUUCMEQMS-UHFFFAOYSA-L
Chemical Structure
2D Structure
2D structure of Mercury bis(trifluoroacetate)
CAS: 13257-51-7
CID: 2723924
Formula: C4F6HgO4
MW: 426.62
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight426.62
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count10
Rotatable Bond Count0
Exact Mass427.940721
Monoisotopic Mass427.940721
Topological Polar Surface Area80.3 Ų
Heavy Atom Count15
Formal Charge0
Complexity77.9
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes