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1-Fluoro-2-iodobenzene

CAT: 0931-TYD-00476-01Size: 25 gDry Ice: NoHazardous: No
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CAT#:0931-TYD-00476-01Size:25 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
348-52-7
Bioactivity
1-Fluoro-2-iodobenzene is a biochemical reagent that can be used as a biomaterial for life science related research and as a sulfonylation reagent for organic synthesis and drug discovery.
Smiles
IC1=CC=CC=C1F
Molecular Formula
C6H4FI
Molecular Weight
221.9988
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1-Fluoro-2-iodobenzene
CAS Number348-52-7
PubChem CID67673
IUPAC Name1-fluoro-2-iodobenzene
Molecular FormulaC6H4FI
Molecular Weight222.00
XLogP3.1
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity74
SMILES
C1=CC=C(C(=C1)F)I
InChI
InChI=1S/C6H4FI/c7-5-3-1-2-4-6(5)8/h1-4H
InChIKey
TYHUGKGZNOULKD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Fluoro-2-iodobenzene
CAS: 348-52-7
CID: 67673
Formula: C6H4FI
MW: 222.00
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight222.00
XLogP33.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass221.93418
Monoisotopic Mass221.93418
Topological Polar Surface Area0 Ų
Heavy Atom Count8
Formal Charge0
Complexity74.9
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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