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22447-55-8 | 3-iodopyridin-1-ium-1-olate
CAS No: 22447-55-8 Catalog No: AG00KGC4 MDL No:MFCD00234059
Product Description
Catalog Number:
AG00KGC4
Chemical Name:
3-iodopyridin-1-ium-1-olate
CAS Number:
22447-55-8
Molecular Formula:
C5H4INO
Molecular Weight:
220.9958
MDL Number:
MFCD00234059
IUPAC Name:
3-iodo-1-oxidopyridin-1-ium
InChI:
InChI=1S/C5H4INO/c6-5-2-1-3-7(8)4-5/h1-4H
InChI Key:
HSTUYDWQSIEIHC-UHFFFAOYSA-N
SMILES:
[O-][n+]1cccc(c1)I
Properties
Complexity:
78.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.934g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.997g/mol
Monoisotopic Mass:
220.934g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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