Basic information
- Standard SMILES
CCS(=O)(=O)c1cnc(Cl)c(Br)c1- InChIKey
IZPBVEDYGRNXAW-UHFFFAOYSA-N- Molecular formula
- C7H7BrClNO2S
- Average molar mass
- 284.56 g/mol
- Monoisotopic mass
- 282.90694
Names & identifiers
- Preferred name
- 3-Bromo-2-chloro-5-(ethylsulfonyl)pyridine
- IUPAC
- 3-bromo-2-chloro-5-ethylsulfonylpyridine
Names & synonyms
3-bromo-2-chloro-5-(ethylsulfonyl)pyridine1227384-85-1SCHEMBL2174000IZPBVEDYGRNXAW-UHFFFAOYSA-NDA-240653-bromo-2-chloro-5-ethanesulfonyl-pyridineA1-29309
Database identifiers
- PubChem CID
- 59326565
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 264
Related reactions
3 records
Compound notes
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