Pyridine, 2-[[(2-methylphenyl)methyl]sulfinyl]-, 1-oxide

HCID 501068

Basic information

CAS
60264-21-3
Standard SMILES
Cc1ccccc1CS(=O)c1cccc[n+]1[O-]
InChIKey
SQZYYVDMXDGIKX-UHFFFAOYSA-N
Molecular formula
C13H13NO2S
Average molar mass
247.31 g/mol
Monoisotopic mass
247.06669966

Names & identifiers

Preferred name
Pyridine, 2-[[(2-methylphenyl)methyl]sulfinyl]-, 1-oxide
IUPAC
2-[(2-methylphenyl)methylsulfinyl]-1-oxidopyridin-1-ium

Names & synonyms

60264-21-3Pyridine, 2-[[(2-methylphenyl)methyl]sulfinyl]-, 1-oxide2-(2-Methylphenylmethylsulfinyl)pyridine N-oxideSCHEMBL11655708DTXSID60333341SQZYYVDMXDGIKX-UHFFFAOYSA-N2-o-Tolylmethanesulfinyl-pyridine, 1-oxide2-(2-Methylphenylmethysulfinyl)pyridine N-oxide2-(o-tolylmethylsulfinyl)-1-oxido-pyridin-1-ium2-[(2-Methylphenyl)methanesulfinyl]-1-oxo-1lambda~5~-pyridine

Database identifiers

CAS
60264-21-3
PubChem CID
501068
DTXSID
DTXSID60333341

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
61.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
17

Related reactions

3 records

Compound notes

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