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3-Thienylmagnesium iodide solution

CAT: 0024-sc-226186Size: 50 mLDry Ice: NoHazardous: No
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CAT#:0024-sc-226186Size:50 mL
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CAS Number
172035-86-8

Chemical Information

Magnesium, iodo-3-thienyl-
CAS Number172035-86-8
PubChem CID10752186
IUPAC Namemagnesium;3H-thiophen-3-ide;iodide
Molecular FormulaC4H3IMgS
Molecular Weight234.34
Topological Polar Surface Area25.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count7
Formal Charge0
Complexity79
SMILES
C1=CSC=[C-]1.[Mg+2].[I-]
InChI
InChI=1S/C4H3S.HI.Mg/c1-2-4-5-3-1;;/h1,3-4H;1H;/q-1;;+2/p-1
InChIKey
PMRZWJCJNHVGQW-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Magnesium, iodo-3-thienyl-
CAS: 172035-86-8
CID: 10752186
Formula: C4H3IMgS
MW: 234.34
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight234.34
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass233.88506
Monoisotopic Mass233.88506
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 Count3
Compound Is CanonicalizedYes