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tert-butyl N-[(2S)-3-bromo-2-methylpropyl]carbamate

CAS 1033465-01-8Formula C9H18BrNO2MW 252.15PubChem 155978015

tert-butyl N-[(2S)-3-bromo-2-methylpropyl]carbamate is a chiral bromo-substituted carbamate, specifically a Boc-protected amine with a bromo-methylpropyl chain. It serves as a versatile synthetic intermediate in organic chemistry, particularly in asymmetric synthesis for the construction of complex molecules.

Loading RDKit molecule structure...
InChIKey: HYTMOLGBQNHTPA-SSDOTTSWSA-NC9H18BrNO2 | MW 252.15

Chemical Identity

Molecular Formula

C9H18BrNO2

Molecular Weight

252.15 g/mol

Exact Mass

251.05209

PubChem CID

155978015

SMILES String

C[C@H](CBr)CNC(=O)OC(C)(C)C

Names & Synonyms

tert-butyl N-((2S)-3-bromo-2-methylpropyl)carbamate966-687-2
External Identifiers
RefChem:894934EN300-27160454

Catalog Overview

tert-butyl N-[(2S)-3-bromo-2-methylpropyl]carbamate is an enantiomerically pure organic compound featuring a tert-butyl carbamate (Boc) protecting group on an amine, and a bromine atom on a methylpropyl chain. The (2S) stereochemistry indicates a specific spatial arrangement around the chiral center. This compound's structure makes it a versatile building block in asymmetric synthesis, particularly for introducing protected amine functionalities and subsequent reactions involving the bromine atom, such as nucleophilic substitutions or Grignard reactions, to construct more complex molecules. It is primarily intended for research...

Use Context

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

tert-butyl N-[(2S)-3-bromo-2-methylpropyl]carbamate is an enantiomerically pure organic compound featuring a tert-butyl carbamate (Boc) protecting group on an amine, and a bromine atom on a methylpropyl chain. The (2S) stereochemistry indicates a specific spatial arrangement around the chiral center. This compound's structure makes it a versatile building block in asymmetric synthesis, particularly for introducing protected amine functionalities and subsequent reactions involving the bromine atom, such as nucleophilic substitutions or Grignard reactions, to construct more complex molecules. It is primarily intended for research use as a functionalized intermediate.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

white solid

Physical State

solid

Melting Point

30.5 °C

Boiling Point

260.6 °C

Density

1.22 g/cm³

Water Solubility

3.39 × 10⁻³ mol/L

Flash Point

120.1 °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 to avoid inhalation. Avoid contact with skin and eyes. In case of contact, rinse immediately with plenty of water. Store in a cool, dry place, away from incompatible materials. Always consult the Safety Data Sheet (SDS) for detailed hazard information and safe handling procedures before use.

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