MolGraphChemical Intelligence
Active Chemical RecordCatalog PreviewCatalog ready

1-Azetidinecarboxylic acid, 3-(bromomethyl)-3-methyl-, 1,1-dimethylethyl ester

CAS 1408075-52-4Formula C10H18BrNO2MW 264.16PubChem 72207957

tert-Butyl 3-(bromomethyl)-3-methylazetidine-1-carboxylate is a functionalized azetidine derivative, commonly employed as a versatile building block in organic synthesis for research applications.

Loading RDKit molecule structure...
InChIKey: AIQVICNBUVBHFX-UHFFFAOYSA-NC10H18BrNO2 | MW 264.16

Chemical Identity

Molecular Formula

C10H18BrNO2

Molecular Weight

264.16 g/mol

Exact Mass

263.05209

PubChem CID

72207957

IUPAC Name

tert-butyl 3-(bromomethyl)-3-methylazetidine-1-carboxylate

SMILES String

CC1(CBr)CN(C(=O)OC(C)(C)C)C1

Names & Synonyms

855-821-41-Boc-3-bromomethyl-3-methylazetidine1-Boc-3-(Bromomethyl)-3-methylazetidinetert-Butyl 3-(bromomethyl)-3-methyl-azetidine-1-carboxylateP13564
Show all synonyms
F503715tert-butyl3-(bromomethyl)-3-methylazetidine-1-carboxylate2-Methyl-2-propanyl 3-(bromomethyl)-3-methyl-1-azetidinecarboxylate
External Identifiers
DTXSID301136887RefChem:429554DTXCID301568501MFCD23106024SCHEMBL20137006IGC07552AKOS025396157PB37223SB20737AS-51800SY100000DB-173727CS-0048368EN300-7289647

Catalog Overview

This compound, also known as 1-Azetidinecarboxylic acid, 3-(bromomethyl)-3-methyl-, 1,1-dimethylethyl ester, features a Boc-protected azetidine ring with a bromomethyl group and a methyl group at the 3-position. Its unique structure makes it a valuable intermediate for introducing azetidine scaffolds into more complex molecules, particularly in medicinal chemistry and materials science research. The bromomethyl functionality provides a reactive site for various coupling reactions and nucleophilic substitutions.

Use Context

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

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

white solid

Physical State

solid

Melting Point

85.0 °C

Boiling Point

280.0 °C

Density

1.23 g/cm³

Water Solubility

slightly soluble

Flash Point

107.1 °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 with appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Use in a well-ventilated area or fume hood. Avoid inhalation, ingestion, and skin contact. Refer to the Safety Data Sheet (SDS) for detailed hazard information and safe handling procedures. Store in a cool, dry place away from incompatible materials.

Related Products / Graph Discovery

Related products, derivatives, keywords, and application cues for catalog discovery.

Related products and analog discovery will be available as catalog graph data is expanded.