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Tert-butyl 4-(bromomethyl)-3-methylpiperidine-1-carboxylate

CAS 2229639-79-4Formula C12H22BrNO2MW 292.21PubChem 145876202

Tert-butyl 4-(bromomethyl)-3-methylpiperidine-1-carboxylate is a bromomethylated piperidine derivative, commonly used as a building block in organic synthesis. It features a tert-butyl carbamate (Boc) protecting group on the piperidine nitrogen, making it a versatile intermediate for creating complex nitrogen-containing heterocyclic compounds in research applications.

Loading RDKit molecule structure...
InChIKey: YWJVWWMRIFCFID-UHFFFAOYSA-NC12H22BrNO2 | MW 292.21

Chemical Identity

Molecular Formula

C12H22BrNO2

Molecular Weight

292.21 g/mol

Exact Mass

291.08339

PubChem CID

145876202

SMILES String

CC1CN(C(=O)OC(C)(C)C)CCC1CBr

Names & Synonyms

980-649-2tert-butyl4-(bromomethyl)-3-methylpiperidine-1-carboxylate,Mixtureofdiastereomers
External Identifiers
RefChem:893826EN300-1903630

Catalog Overview

Tert-butyl 4-(bromomethyl)-3-methylpiperidine-1-carboxylate is a versatile research chemical with the molecular formula C12H22BrNO2 and a molecular weight of 292. 21 g/mol. It is characterized by a piperidine ring substituted with a bromomethyl group at position 4 and a methyl group at position 3, with the nitrogen protected by a tert-butyl carbamate (Boc) group. This compound serves as a key intermediate in organic synthesis, especially in the construction of diverse pharmaceutical candidates and agrochemicals.

Use Context

  • Research chemical sourcing
  • Custom synthesis and catalog availability review
  • COA, SDS, pricing, and fulfillment workflow
Read more catalog context

Tert-butyl 4-(bromomethyl)-3-methylpiperidine-1-carboxylate is a versatile research chemical with the molecular formula C12H22BrNO2 and a molecular weight of 292.21 g/mol. It is characterized by a piperidine ring substituted with a bromomethyl group at position 4 and a methyl group at position 3, with the nitrogen protected by a tert-butyl carbamate (Boc) group. This compound serves as a key intermediate in organic synthesis, especially in the construction of diverse pharmaceutical candidates and agrochemicals. The bromomethyl group provides a reactive site for various coupling reactions, nucleophilic substitutions, and further functionalization, while the Boc group allows for selective deprotection and subsequent reactions involving the piperidine nitrogen. Its structure makes it valuable for synthesizing complex heterocyclic systems for research and development.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

white crystalline solid

Physical State

solid

Melting Point

80.0 °C

Boiling Point

300.0 °C

Density

1.2 g/cm³

Water Solubility

insoluble

Flash Point

165.0 °C

Applications / Classifications

Research intermediateCustom synthesis building block

Biological Target Reference

No verified biological target assignment. This compound is listed primarily as a research or synthetic intermediate.

Preliminary Safety-Style Reference

Preliminary

Preliminary safety-style information for reference only. Not a supplier SDS.

Handling and Storage
  • Handle Tert-butyl 4-(bromomethyl)-3-methylpiperidine-1-carboxylate in a well-ventilated area or fume hood. Wear appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Avoid inhalation of dust or vapors, and prevent skin and eye contact. In case of contact, rinse immediately with plenty of water. Store in a cool, dry place, away from incompatible materials. This compound is for research use only and not for human or animal therapeutic or diagnostic use.

Related Products / Graph Discovery

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