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TCI

CAS 4068-76-2

Methyl 5-Bromo-2-hydroxybenzoate TCI B6380

Methyl 5-Bromo-2-hydroxybenzoate TCI B6380

Chemical Identity

Other names
Methyl 5-Bromosalicylate · Methyl 5-Bromo-2-hydroxybenzenecarboxylate · Bromo-2-(methoxycarbonyl)phenol
CAS No.
4068-76-2
Formula
C8H7BrO3
Molecular weight
231.05 g/mol
Purity
>95.0%(GC)
Full identifiers (IUPAC, SMILES, InChIKey)
IUPAC
methyl 5-bromo-2-hydroxybenzoate
SMILES
COC(=O)C1=C(C=CC(=C1)Br)O
InChIKey
FJYDBKPPGRZSOZ-UHFFFAOYSA-N
MDL
MDL00016460
PubChem
CID 77683
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TCI B6380, methyl 5-bromo-2-hydroxybenzoate (CAS 4068-76-2), also known as methyl 5-bromosalicylate, is a trifunctional building block bearing a phenolic hydroxyl, a methyl ester, and an aryl bromide on a single compact scaffold. The phenol can be alkylated or acylated, the ester hydrolysed or converted to amides, and the bromide engaged in palladium-catalysed cross-coupling, allowing chemists to sequence transformations exactly as their route requires. The adjacent hydroxyl and carbonyl groups also make it a convenient precursor to salicylate-type chelating ligands and Schiff bases for coordination chemistry. AMI Scientific supplies this TCI building block in 5 g and 25 g pack sizes for medicinal chemistry, ligand design, and materials research.

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