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(3-Bromo-1-methylpropyl)carbamic acid tert-butyl ester

CAS 128412-15-7Formula C9H18BrNO2MW 252.15PubChem 72345830

tert-Butyl N-(4-bromobutan-2-yl)carbamate is a functionalized intermediate featuring a tert-butyl carbamate protecting group and a reactive bromine atom. It is primarily used as a versatile building block in organic synthesis.

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

Chemical Identity

Molecular Formula

C9H18BrNO2

Molecular Weight

252.15 g/mol

Exact Mass

251.05209

PubChem CID

72345830

IUPAC Name

tert-butyl N-(4-bromobutan-2-yl)carbamate

SMILES String

CC(CCBr)NC(=O)OC(C)(C)C

Names & Synonyms

tert-Butyl (4-bromobutan-2-yl)carbamate2-(Boc-amino)-4-bromobutanetert-Butyl(4-bromobutan-2-yl)carbamateI10925tert-butyl N-(3-bromo-1-methyl-propyl)carbamate
Show all synonyms
F501472
External Identifiers
MFCD22576327SCHEMBL4745621AKOS027251209AS-49494SY244626DB-309865CS-0045328

Catalog Overview

tert-Butyl N-(4-bromobutan-2-yl)carbamate is an organic compound characterized by a tert-butyl carbamate (Boc) protecting group and a bromine atom on a four-carbon chain. The Boc group serves to protect an amine functionality, while the bromine atom acts as a reactive site for various synthetic transformations. This compound is classified as a functionalized intermediate, making it valuable in multi-step organic synthesis.

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

Colorless liquid

Physical State

Liquid

Melting Point

15.0 °C

Boiling Point

270.0 °C

Density

1.25 g/cm³

Water Solubility

Slightly soluble

Flash Point

120.0 °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 with appropriate personal protective equipment, including chemical-resistant gloves, safety glasses, and a lab coat. Use in a well-ventilated area or a fume hood to prevent 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 comprehensive safety information before use.

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