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Home > Fluorides > 124666-05-3
124666-05-3 | Pyridine, 4-fluoro-, 1-oxide
CAS No: 124666-05-3 Catalog No: AG000ML2 MDL No:MFCD17018658
Product Description
Catalog Number:
AG000ML2
Chemical Name:
Pyridine, 4-fluoro-, 1-oxide
CAS Number:
124666-05-3
Molecular Formula:
C5H4FNO
Molecular Weight:
113.0898
MDL Number:
MFCD17018658
IUPAC Name:
4-fluoro-1-oxidopyridin-1-ium
InChI:
InChI=1S/C5H4FNO/c6-5-1-3-7(8)4-2-5/h1-4H
InChI Key:
FJRXJYYAEVHIDK-UHFFFAOYSA-N
SMILES:
[O-][n+]1ccc(cc1)F
Properties
Complexity:
70.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
113.028g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
113.091g/mol
Monoisotopic Mass:
113.028g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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