1-Bromo-4-iodobenzene (C6H4BrI)

1-Bromo-4-iodobenzene presents a C6 framework, aromatic rings, halogen substitution (formula C6H4BrI, CAS 589-87-7). ChemicalTool Reaction can propose ranked disconnections for 1-Bromo-4-iodobenzene from the SMILES Brc1ccc(I)cc1.

Target: 1-Bromo-4-iodobenzene
CAS: 589-87-7
Formula: C6H4BrI
Approx. MW: 282.90
SMILES: Brc1ccc(I)cc1
PubChem CID: 11522
Approx. carbons: C6

1-Bromo-4-iodobenzene structure

Properties

Molecular weight: 282.90

View on PubChem

1-Bromo-4-iodobenzene 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 1-Bromo-4-iodobenzene?

1-Bromo-4-iodobenzene has molecular formula C6H4BrI. Molecular weight about 282.90 g·mol⁻¹.

What is the CAS number of 1-Bromo-4-iodobenzene?

The CAS Registry Number for 1-Bromo-4-iodobenzene is 589-87-7.

Run AI retrosynthesis for 1-Bromo-4-iodobenzene Target catalog AI tools overview

One click loads 1-Bromo-4-iodobenzene into ChemicalTool Reaction for route exploration.

Related targets

Similar compounds

1-Bromo-2-Iodobenzene (3-bromophenyl)boronic Acid 1-Bromo-2-chloro-3-fluorobenzene 1-Bromo-2-chlorobenzene 1-Bromo-3-chlorobenzene 1-Bromo-4-chlorobenzene

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References & tools

ChemicalTool Reaction — AI retrosynthesis with optional library evidence.
PubChem — compound identifiers and structure depictions (NIH/NCBI).
Related: AiZynthFinder / synthesis planning literature for computer-aided retrosynthesis.