Basic information
- Standard SMILES
OSc1cnc(Cl)c(Br)c1- InChIKey
UNGZAXXKGQTTKC-UHFFFAOYSA-N- Molecular formula
- C5H3BrClNOS
- Average molar mass
- 240.51 g/mol
Names & identifiers
- Preferred name
- 5-Bromo-6-chloro-pyridine-3-sulphenic acid
- IUPAC
- 3-bromo-2-chloro-5-hydroxysulfanylpyridine
Names & synonyms
SCHEMBL5840200UNGZAXXKGQTTKC-UHFFFAOYSA-N5-bromo-6-chloro-pyridine-3-sulphenic acid
Database identifiers
- PubChem CID
- 21886501
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 58.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 118
Related reactions
6 records
Compound notes
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