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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 22665708Generated: October 28, 2026

Isoquinoline, 5-bromo-, 2-oxide

https://huagongshe.com/en/chemical/22665708

Isoquinoline, 5-bromo-, 2-oxide molecular structure

Identifiers & Physical Properties

Molecular formulaC9H6BrNO
Average molar mass224.05 g/mol
Monoisotopic mass222.96328 g/mol
SMILES[O-][n+]1ccc2c(Br)cccc2c1
InChIKeyZMMWTYNVRSUXFF-UHFFFAOYSA-N
PubChem CID22665708

Chemical & Physical Properties

XLogP1.8
Topological polar surface area25.5
Hydrogen bond donors0
Hydrogen bond acceptors1
Rotatable bonds0
Heavy atoms12
Formal charge0
Complexity165