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2-Ethynyl-6-fluoropyridine

CAT: 0931-TYD-02862-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-TYD-02862-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1233205-73-6
Target
Others
Related Pathways
Others
Bioactivity
2-Ethynyl-6-fluoropyridine is a nitrogen-containing heterocyclic organic compound, and 2-Ethynyl-6-fluoropyridine functions as an important synthetic intermediate used for generating various active chemical entities. 2-Ethynyl-6-fluoropyridine supports the construction of functionalized pyridine derivatives and advanced molecular scaffolds, thereby contributing to pharmaceutical chemistry, agrochemical development, and heterocyclic building-block design.
Smiles
FC=1N=C(C#C)C=CC1
Molecular Formula
C7H4FN
Molecular Weight
121.11
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2-Ethynyl-6-fluoropyridine
CAS Number1233205-73-6
PubChem CID58574354
IUPAC Name2-ethynyl-6-fluoropyridine
Molecular FormulaC7H4FN
Molecular Weight121.11
XLogP1.6
Topological Polar Surface Area12.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity135
SMILES
C#CC1=NC(=CC=C1)F
InChI
InChI=1S/C7H4FN/c1-2-6-4-3-5-7(8)9-6/h1,3-5H
InChIKey
JFEWFXHNPSMINO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Ethynyl-6-fluoropyridine
CAS: 1233205-73-6
CID: 58574354
Formula: C7H4FN
MW: 121.11
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight121.11
XLogP31.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass121.032777294
Monoisotopic Mass121.032777294
Topological Polar Surface Area12.9 Ų
Heavy Atom Count9
Formal Charge0
Complexity135
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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