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tert-butyl N-(4-bromobutyl)-N-methylcarbamate

CAS 188793-11-5Formula C10H20BrNO2MW 266.18PubChem 85722826

tert-butyl N-(4-bromobutyl)-N-methylcarbamate is a bromo-substituted carbamate primarily used as a functionalized intermediate in organic synthesis. It is valuable for introducing a protected methylcarbamate group along with a reactive bromoalkyl chain, enabling diverse alkylation and further functionalization reactions in research settings.

Loading RDKit molecule structure...
InChIKey: CAUPIPOOFDSKNK-UHFFFAOYSA-NC10H20BrNO2 | MW 266.18

Chemical Identity

Molecular Formula

C10H20BrNO2

Molecular Weight

266.18 g/mol

Exact Mass

265.06774

PubChem CID

85722826

SMILES String

CN(CCCCBr)C(=O)OC(C)(C)C

Names & Synonyms

991-025-4TERT-BUTYL (4-BROMOBUTYL)(METHYL)CARBAMATEt-Butyl (4-bromobutyl)(methyl)carbamatetert-butyl N-(4-bromobutyl)-N-methyl-carbamate
External Identifiers
RefChem:896120MFCD32739318SCHEMBL19635138AT11151DB-214513EN300-1267386

Catalog Overview

tert-butyl N-(4-bromobutyl)-N-methylcarbamate (CAS 188793-11-5) is an organic compound with the molecular formula C10H20BrNO2 and a molecular weight of 266. 18 g/mol. It features a tert-butyl carbamate protecting group on a methylamine, which is further substituted with a 4-bromobutyl chain. This bifunctional nature makes it a valuable building block in synthetic chemistry.

Use Context

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Read more catalog context

tert-butyl N-(4-bromobutyl)-N-methylcarbamate (CAS 188793-11-5) is an organic compound with the molecular formula C10H20BrNO2 and a molecular weight of 266.18 g/mol. It features a tert-butyl carbamate protecting group on a methylamine, which is further substituted with a 4-bromobutyl chain. This bifunctional nature makes it a valuable building block in synthetic chemistry. The bromoalkyl moiety can undergo various nucleophilic substitution reactions (e.g., with amines, thiols, or alcohols) or participate in metal-catalyzed cross-coupling reactions after conversion to a Grignard reagent or organolithium compound. The tert-butyl carbamate (Boc) group serves as a common protecting group for the nitrogen atom, which can be selectively deprotected under acidic conditions to yield the free secondary amine. This compound is typically employed in the synthesis of more complex molecules, including pharmaceuticals, agrochemicals, and materials science research.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

Colorless liquid

Physical State

Liquid

Melting Point

-10.0 °C

Boiling Point

275.0 °C

Density

1.25 g/cm³

Water Solubility

Slightly soluble

Flash Point

140.0 °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 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. May cause irritation to skin, eyes, and respiratory tract. Refer to the Safety Data Sheet (SDS) for detailed hazard information and emergency procedures. Store in a cool, dry place, away from incompatible materials.

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