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5-Fluoro-2-methyl-3-nitropyridine

CAT: 0127-PC1006937-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-PC1006937-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1162674-71-6
MDL Number
MFCD12196975
Purity
97%
Smiles
O=[N+](C1=CC(F)=CN=C1C)[O-]

Chemical Information

5-Fluoro-2-methyl-3-nitropyridine
CAS Number1162674-71-6
PubChem CID59845978
IUPAC Name5-fluoro-2-methyl-3-nitropyridine
Molecular FormulaC6H5FN2O2
Molecular Weight156.11
XLogP1.2
Topological Polar Surface Area58.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity159
SMILES
CC1=C(C=C(C=N1)F)[N+](=O)[O-]
InChI
InChI=1S/C6H5FN2O2/c1-4-6(9(10)11)2-5(7)3-8-4/h2-3H,1H3
InChIKey
NYYWLHUMRSTCCV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Fluoro-2-methyl-3-nitropyridine
CAS: 1162674-71-6
CID: 59845978
Formula: C6H5FN2O2
MW: 156.11
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight156.11
XLogP31.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass156.03350557
Monoisotopic Mass156.03350557
Topological Polar Surface Area58.7 Ų
Heavy Atom Count11
Formal Charge0
Complexity159
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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Alternative Products

CatalogName
417933-012-Fluoro-5-methyl-3-nitropyridine
417829-012-Fluoro-4-methyl-5-nitropyridine
425752-013-Fluoro-6-methyl-2-nitropyridine
438555-016-Fluoro-2-methyl-3-nitropyridine
sc-2812882-Fluoro-6-methyl-3-nitropyridine
EFC33155-01Methyl 6-fluoro-5-nitropyridine-3-carboxylate
sc-283146A2-Fluoro-5-nitropyridine
436518-015-Fluoro-2-nitropyridine
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