3-Bromo-5-(methylsulfinyl)pyridine

HCID 58485334
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Basic information

Standard SMILES
CS(=O)c1cncc(Br)c1
InChIKey
BOOKYSHCUVWSNW-UHFFFAOYSA-N
Molecular formula
C6H6BrNOS
Average molar mass
220.09 g/mol
Monoisotopic mass
218.93535

Names & identifiers

Preferred name
3-Bromo-5-(methylsulfinyl)pyridine
IUPAC
3-bromo-5-methylsulfinylpyridine

Names & synonyms

3-Bromo-5-(methylsulfinyl)pyridine1193245-15-6SCHEMBL1403825BOOKYSHCUVWSNW-UHFFFAOYSA-N3-Bromo-5-methanesulfinyl-pyridine

Database identifiers

PubChem CID
58485334

Properties

Computed structural properties

XLogP
0.7
Topological polar surface area
49.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
10

Related reactions

2 records
New reaction record

Compound notes

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