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2-Picolinium, 1,1'-(p',p'-biphenylylenebis(carbonylmethyl))di-, dibromide

HCID 88448
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Basic information

CAS
20275-19-8
Standard SMILES
Cc1cccc[n+]1CC(=O)c1ccc(-c2ccc(C(=O)C[n+]3ccccc3C)cc2)cc1.[Br-].[Br-]
InChIKey
QGCMBZODJHRGQM-UHFFFAOYSA-L
Molecular formula
C28H26Br2N2O2
Average molar mass
582.3 g/mol
Monoisotopic mass
580.0361

Names & identifiers

Preferred name
2-Picolinium, 1,1'-(p',p'-biphenylylenebis(carbonylmethyl))di-, dibromide
IUPAC
2-(2-methylpyridin-1-ium-1-yl)-1-[4-[4-[2-(2-methylpyridin-1-ium-1-yl)acetyl]phenyl]phenyl]ethanone dibromide

Names & synonyms

2-Picolinium, 1,1'-(p',p'-biphenylylenebis(carbonylmethyl))di-, dibromideRefChem:106418820275-19-8NSC 1524362-Picolinium, 1,1'-(4,4'-biphenylylenebis(2-oxoethylene))di-, dibromide1,1'-(4,4'-Biphenylenebis(2-oxoethylene))bis(2-methylpyridinium) dibromidePyridinium, 1,1'-(4,4'-biphenylenebis(2-oxoethylene))bis(2-methyl-, dibromidePyridinium, 1,1'-((1,1'-biphenyl)-4,4'-diylbis(2-oxo-2,1-ethanediyl))bis(2-methyl-, dibromide

Database identifiers

CAS
20275-19-8
PubChem CID
88448

Properties

Computed structural properties

Topological polar surface area
41.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
34
Formal charge
0
Complexity
565

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