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tert-butyl N-(5-bromopentyl)-N-methylcarbamate

CAS 1694011-13-6Formula C11H22BrNO2MW 280.2PubChem 107206130

tert-butyl N-(5-bromopentyl)-N-methylcarbamate is a functionalized intermediate featuring a protected N-methylamine and a terminal bromo group on a pentyl chain. It is primarily used in organic synthesis as a versatile building block for creating more complex molecules for research purposes.

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

Chemical Identity

Molecular Formula

C11H22BrNO2

Molecular Weight

280.2 g/mol

Exact Mass

279.08339

PubChem CID

107206130

SMILES String

CN(CCCCCBr)C(=O)OC(C)(C)C

Names & Synonyms

878-342-2TERT-BUTYL (5-BROMOPENTYL)(METHYL)CARBAMATEtert-butylN-(5-bromopentyl)-N-methylcarbamatetert-butyl N-(5-bromopentyl)-N-methyl-carbamate
External Identifiers
RefChem:896234SCHEMBL19635933AT11153DB-419077CS-0530012EN300-7160657

Catalog Overview

tert-butyl N-(5-bromopentyl)-N-methylcarbamate, identified by CAS 1694011-13-6, is an organic compound with the molecular formula C11H22BrNO2 and a molecular weight of 280. 20 g/mol. This molecule incorporates a tert-butyl carbamate (Boc) protecting group on an N-methylamine, attached to a 5-bromopentyl chain. The presence of both a protected amine and a reactive alkyl bromide makes it a valuable intermediate in multi-step organic synthesis.

Use Context

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Read more catalog context

tert-butyl N-(5-bromopentyl)-N-methylcarbamate, identified by CAS 1694011-13-6, is an organic compound with the molecular formula C11H22BrNO2 and a molecular weight of 280.20 g/mol. This molecule incorporates a tert-butyl carbamate (Boc) protecting group on an N-methylamine, attached to a 5-bromopentyl chain. The presence of both a protected amine and a reactive alkyl bromide makes it a valuable intermediate in multi-step organic synthesis. It can be utilized in various coupling reactions, nucleophilic substitutions, and as a precursor for synthesizing diverse nitrogen-containing compounds, particularly in pharmaceutical and agrochemical research.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

colorless

Physical State

liquid

Melting Point

23.4 °C

Boiling Point

307.0 °C

Density

1.18 g/cm³

Water Solubility

2.18 × 10⁻³ mol/L

Flash Point

127.0 °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
  • When handling tert-butyl N-(5-bromopentyl)-N-methylcarbamate, researchers should adhere to standard laboratory safety practices. This includes wearing appropriate personal protective equipment such as gloves, eye protection, and a lab coat. Work in a well-ventilated area or under a fume hood to avoid inhalation. Avoid contact with skin and eyes. In case of contact, rinse thoroughly with water. Store the compound in a cool, dry place, away from incompatible materials. Consult the Safety Data Sheet (SDS) for comprehensive safety information before use.

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