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3-Fluoropicolinonitrile

CAT: 0572-TRC-F621220-25GSize: 25 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-F621220-25GSize:25 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
97509-75-6
Hazard Statement
No Data Available
Purity
>95% (HPLC)
Smiles
Fc1cccnc1C#N
Molecular Formula
C6H3FN2
Molecular Weight
122.1
Shipping Conditions
Room Temperature
Storage Conditions
+4°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

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PC251352-016-Bromo-3-fluoropicolinonitrile
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PC251359-016-Chloro-3-fluoropicolinonitrile
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PC1026292-016-Bromo-4-fluoropicolinonitrile
PC111235-015-Bromo-6-fluoropicolinonitrile
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