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tert-butyl N-(3-bromopropyl)-N-(propan-2-yl)carbamate

CAS 1525991-29-0Formula C11H22BrNO2MW 280.2PubChem 53807172

This compound is a functionalized intermediate, specifically a tert-butyl carbamate derivative containing a bromopropyl group and an isopropyl group. It is primarily used in organic synthesis as a building block for creating more complex molecules, particularly in pharmaceutical research and fine chemical development.

Loading RDKit molecule structure...
InChIKey: FMNMFUAKDFDIMP-UHFFFAOYSA-NC11H22BrNO2 | MW 280.2

Chemical Identity

Molecular Formula

C11H22BrNO2

Molecular Weight

280.2 g/mol

Exact Mass

279.08339

PubChem CID

53807172

IUPAC Name

tert-butyl N-(3-bromopropyl)-N-propan-2-ylcarbamate

SMILES String

CC(C)N(CCCBr)C(=O)OC(C)(C)C

Names & Synonyms

tert-butylN-(3-bromopropyl)-N-(propan-2-yl)carbamate
External Identifiers
SCHEMBL8328107EN300-174600

Catalog Overview

tert-butyl N-(3-bromopropyl)-N-(propan-2-yl)carbamate, identified by CAS 1525991-29-0, is an organic compound with the molecular formula C11H22BrNO2 and a molecular weight of 280. 20 g/mol. It features a tert-butyl carbamate protecting group on a nitrogen atom, which is also substituted with an isopropyl group and a 3-bromopropyl chain. This structure makes it a versatile functionalized intermediate in synthetic chemistry.

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Read more catalog context

tert-butyl N-(3-bromopropyl)-N-(propan-2-yl)carbamate, identified by CAS 1525991-29-0, is an organic compound with the molecular formula C11H22BrNO2 and a molecular weight of 280.20 g/mol. It features a tert-butyl carbamate protecting group on a nitrogen atom, which is also substituted with an isopropyl group and a 3-bromopropyl chain. This structure makes it a versatile functionalized intermediate in synthetic chemistry. The bromo-group serves as a reactive site for various coupling reactions, nucleophilic substitutions, or further functionalization, while the carbamate group can be selectively deprotected to yield a secondary amine. Its utility lies in the construction of diverse chemical scaffolds, particularly in the synthesis of nitrogen-containing heterocycles and complex organic molecules for research purposes.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

colorless to pale yellow liquid

Physical State

liquid

Melting Point

-10.0 °C

Boiling Point

250.0 °C

Density

1.1 g/cm³

Water Solubility

insoluble

Flash Point

115.0 °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 N-(3-bromopropyl)-N-(propan-2-yl)carbamate in a well-ventilated area or fume hood. Wear appropriate personal protective equipment, including safety goggles, chemical-resistant gloves (e.g., nitrile), 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. Always consult the Safety Data Sheet (SDS) for comprehensive safety information before use.

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