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Compound Fr14099

CAT: 0931-Fr14099-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-Fr14099-01Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
97509-75-6
Purity
0.9995
Bioactivity
Compound Fr14099, with CAS No. 97509-75-6, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound Fr14099 provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.
Smiles
FC1=CC=CN=C1C#N
Molecular Formula
C6H3FN2
Molecular Weight
122.1
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2-Cyano-3-fluoropyridine
CAS Number97509-75-6
PubChem CID7060408
IUPAC Name3-fluoropyridine-2-carbonitrile
Molecular FormulaC6H3FN2
Molecular Weight122.10
XLogP1
Topological Polar Surface Area36.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count9
Formal Charge0
Complexity137
SMILES
C1=CC(=C(N=C1)C#N)F
InChI
InChI=1S/C6H3FN2/c7-5-2-1-3-9-6(5)4-8/h1-3H
InChIKey
VZFPSCNTFBJZHB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Cyano-3-fluoropyridine
CAS: 97509-75-6
CID: 7060408
Formula: C6H3FN2
MW: 122.10
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight122.10
XLogP31
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass122.02802627
Monoisotopic Mass122.02802627
Topological Polar Surface Area36.7 Ų
Heavy Atom Count9
Formal Charge0
Complexity137
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

Related Products

CatalogName
Fr14090-01Compound Fr14090
Fr14039-01Compound Fr14039
Fr14399-01Compound Fr14399
Fr14094-01Compound Fr14094
Fr13099-01Compound Fr13099
Fr14019-01Compound Fr14019
Fr14097-01Compound Fr14097
Fr14299-01Compound Fr14299
Fr14059-01Compound Fr14059
Fr14091-01Compound Fr14091

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