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tert-butyl N-[(2S)-4-bromobutan-2-yl]carbamate

CAS 106622-20-2Formula C9H18BrNO2MW 252.15PubChem 59641998

tert-butyl N-[(2S)-4-bromobutan-2-yl]carbamate is a chiral, brominated organic compound featuring a tert-butyl carbamate protecting group. With the molecular formula C9H18BrNO2, it serves as a versatile functionalized intermediate in synthetic organic chemistry for research applications.

Loading RDKit molecule structure...
InChIKey: BLROSIRAEKEFNI-ZETCQYMHSA-NC9H18BrNO2 | MW 252.15

Chemical Identity

Molecular Formula

C9H18BrNO2

Molecular Weight

252.15 g/mol

Exact Mass

251.05209

PubChem CID

59641998

SMILES String

C[C@@H](CCBr)NC(=O)OC(C)(C)C

Names & Synonyms

tert-butyl N-((2S)-4-bromobutan-2-yl)carbamate879-234-8tert-butylN-[(2S)-4-bromobutan-2-yl]carbamate(S)-tert-Butyl (4-bromobutan-2-yl)carbamatetert-Butyl (S)-(4-bromobutan-2-yl)carbamate
Show all synonyms
G62542
External Identifiers
RefChem:894940SCHEMBL25075346CS-0376284EN300-8206456

Catalog Overview

tert-butyl N-[(2S)-4-bromobutan-2-yl]carbamate, identified by CAS 106622-20-2, is a precisely structured organic compound with a molecular weight of 252.15 g/mol. This molecule incorporates a bromine atom at the 4-position and a tert-butyl carbamate (Boc) group protecting the amine at the 2-position of a butane chain, featuring an (S)-stereocenter. It is primarily utilized as a key functionalized intermediate in the synthesis of complex organic molecules, particularly in pharmaceutical and agrochemical research, where its chiral nature and reactive bromine group can be leveraged for further transformations.

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

35.0 °C

Boiling Point

260.6 °C

Density

1.22 g/cm³

Water Solubility

3.28 × 10⁻³ mol/L

Flash Point

128.8 °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 N-[(2S)-4-bromobutan-2-yl]carbamate with appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Work in a well-ventilated area or fume hood to avoid inhalation. Prevent skin and eye contact, and do not ingest. In case of exposure, seek immediate medical attention. Store in a cool, dry place, away from incompatible materials. Dispose of waste according to local regulations for chemical waste.

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