1-Benzylpyridinium 3-sulfonate structure

1-Benzylpyridinium 3-sulfonate

1-benzylpyridin-1-ium-3-sulfonate

Also Known As: 1-benzylpyridinium 3-sulfonate|1-benzylpyridin-1-ium-3-sulfonate|1-(Benzyl)-3-sulphonatopyridinium|EINECS 274-098-0|1- -3-sulphonatopyridinium|1-Benzyl-3-sulfonatopyridinium|1-benzylpyridinium-3-sulfonate|1-(phenylmethyl)pyridinium-3-sulfonate|PYRIDINIUM, 1-(PHENYLMETHYL)-3-SULFO-, INNER SALT|Pyridinium, 1-(phenylmethyl)-3-sulfo-,?inner salt|PYRIDINIUM, 1-(PHENYLMETHYL)-3-SULFO-, HYDROXIDE, INNER SALT|274-098-0

CAS: 69723-94-0
Molecular Formula C12H11NO3S
Molecular Weight 249.04596 g/mol
LogP 0.9265
Topological Polar Surface Area 61.08 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 3
Exact Mass 249.04596
Monoisotopic Mass 249.04596
Heavy Atoms 17
Complexity 608.6577

Chemical Identifiers

CAS Number 69723-94-0
SMILES C1=CC=C(C=C1)C[N+]2=CC=CC(=C2)S(=O)(=O)[O-]

Product Overview

1-Benzylpyridinium 3-sulfonate (CAS 69723-94-0), with molecular formula C12H11NO3S and molecular weight 249.04596 g/mol. IUPAC: 1-benzylpyridin-1-ium-3-sulfonate.

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