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Bis (Pentafluorophenyl) Zinc

CAT: 0127-PC109914Size: 1 EachDry Ice: NoHazardous: No
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CAS Number
1799-90-2
MDL Number
MFCD03701564
Purity
=95%
Smiles
FC1=C(F)C(F)=C([Zn]C2=C(F)C(F)=C(F)C(F)=C2F)C(F)=C1F

Chemical Information

Bis(pentafluorophenyl)zinc
CAS Number1799-90-2
PubChem CID3495745
IUPAC Namezinc bis(1,2,3,4,5-pentafluorobenzene-6-ide)
Molecular FormulaC12F10Zn
Molecular Weight399.5
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count12
Rotatable Bond Count0
Heavy Atom Count23
Formal Charge0
Complexity578
SMILES
[C-]1=C(C(=C(C(=C1F)F)F)F)F.[C-]1=C(C(=C(C(=C1F)F)F)F)F.[Zn+2]
InChI
InChI=1S/2C6F5.Zn/c2*7-2-1-3(8)5(10)6(11)4(2)9;/q2*-1;+2
InChIKey
TURVSLXVJYZFII-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bis(pentafluorophenyl)zinc
CAS: 1799-90-2
CID: 3495745
Formula: C12F10Zn
MW: 399.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight399.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count12
Rotatable Bond Count0
Exact Mass397.913173
Monoisotopic Mass397.913173
Topological Polar Surface Area0 Ų
Heavy Atom Count23
Formal Charge0
Complexity578
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