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14549-14-5 | Pyridinium, 2-acetyl-1-methyl-, iodide (1:1)
CAS No: 14549-14-5 Catalog No: AG001D3U MDL No:
Product Description
Catalog Number:
AG001D3U
Chemical Name:
Pyridinium, 2-acetyl-1-methyl-, iodide (1:1)
CAS Number:
14549-14-5
Molecular Formula:
C8H10INO
Molecular Weight:
263.0756
IUPAC Name:
1-(1-methylpyridin-1-ium-2-yl)ethanone;iodide
InChI:
InChI=1S/C8H10NO.HI/c1-7(10)8-5-3-4-6-9(8)2;/h3-6H,1-2H3;1H/q+1;/p-1
InChI Key:
JWIYPDKPPVHBPU-UHFFFAOYSA-M
SMILES:
CC(=O)c1cccc[n+]1C.[I-]
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.981g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.078g/mol
Monoisotopic Mass:
262.981g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
21A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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