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34285-40-0

34285-40-0 | Pyridinium, 4-benzoyl-1-methyl-, iodide (1:1)

CAS No: 34285-40-0 Catalog No: AG007GVG MDL No:

Product Description

Catalog Number:
AG007GVG
Chemical Name:
Pyridinium, 4-benzoyl-1-methyl-, iodide (1:1)
CAS Number:
34285-40-0
Molecular Formula:
C13H12INO
Molecular Weight:
325.1450
IUPAC Name:
(1-methylpyridin-1-ium-4-yl)-phenylmethanone;iodide
InChI:
InChI=1S/C13H12NO.HI/c1-14-9-7-12(8-10-14)13(15)11-5-3-2-4-6-11;/h2-10H,1H3;1H/q+1;/p-1
InChI Key:
PIDOMMCOZZYDFP-UHFFFAOYSA-M
SMILES:
C[n+]1ccc(cc1)C(=O)c1ccccc1.[I-]
NSC Number:
525260

Properties

Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.996g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
325.149g/mol
Monoisotopic Mass:
324.996g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
21A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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