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3-Thienylzinc iodide solution

CAT: 0024-sc-226187Size: 50 mLDry Ice: NoHazardous: No
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CAT#:0024-sc-226187Size:50 mL
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CAS Number
172035-85-7

Chemical Information

3-Thienylzinc iodide
CAS Number172035-85-7
PubChem CID10612464
IUPAC Nameiodozinc(1+);3H-thiophen-3-ide
Molecular FormulaC4H3ISZn
Molecular Weight275.4
Topological Polar Surface Area25.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count7
Formal Charge0
Complexity79
SMILES
C1=CSC=[C-]1.[Zn+]I
InChI
InChI=1S/C4H3S.HI.Zn/c1-2-4-5-3-1;;/h1,3-4H;1H;/q-1;;+2/p-1
InChIKey
YNJXNPTWSQAFPQ-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of 3-Thienylzinc iodide
CAS: 172035-85-7
CID: 10612464
Formula: C4H3ISZn
MW: 275.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight275.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass273.82916
Monoisotopic Mass273.82916
Topological Polar Surface Area25.3 Ų
Heavy Atom Count7
Formal Charge0
Complexity79.8
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