3-bromo-1-benzofuran (C8H5BrO)

3-bromo-1-benzofuran presents a C8 framework, aromatic rings, halogen substitution (formula C8H5BrO, CAS 59214-70-9). ChemicalTool Reaction can propose ranked disconnections for 3-bromo-1-benzofuran from the SMILES Brc1coc2ccccc12.

Target: 3-bromo-1-benzofuran
CAS: 59214-70-9
Formula: C8H5BrO
Approx. MW: 197.03
SMILES: Brc1coc2ccccc12
PubChem CID: 640589
Approx. carbons: C8

3-bromo-1-benzofuran structure

Properties

IUPAC name: 3-bromo-1-benzofuran
Common names: 3-bromo-1-benzofuran; 59214-70-9; benzofuran, 3-bromo-; DTXSID30348765; RefChem:498198; DTXCID60299837; 809-863-5; InChI=1/C8H5BrO/c9-7-5-10-8-4-2-1-3-6(7)8/h1-5; 3-bromobenzofuran; 3-Bromobenzo[b]furan
Molecular weight: 197.03
Exact mass: 195.95
InChIKey: ICJNAOJPUTYWNV-UHFFFAOYSA-N

View on PubChem

3-bromo-1-benzofuran 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 3-bromo-1-benzofuran?

3-bromo-1-benzofuran has molecular formula C8H5BrO. Molecular weight about 197.03 g·mol⁻¹.

What is the CAS number of 3-bromo-1-benzofuran?

The CAS Registry Number for 3-bromo-1-benzofuran is 59214-70-9.

Run AI retrosynthesis for 3-bromo-1-benzofuran Target catalog AI tools overview

One click loads 3-bromo-1-benzofuran into ChemicalTool Reaction for route exploration.

Related targets

Similar compounds

(1-Bromoethyl)benzene (2-Chloroethoxy)benzene (2-Chloroethyl)benzene (Chloroethynyl)benzene [(2-Chloroethyl)sulfonyl]benzene 1-(3-Bromo-4-fluorophenyl)ethanone

Browse the full target catalog

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.