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Tert-butyl (2-bromopropyl)carbamate

CAS 121102-88-3Formula C8H16BrNO2MW 238.12PubChem 14458310

Tert-butyl (2-bromopropyl)carbamate is a bromo-substituted carbamate derivative, commonly employed as a versatile building block in organic synthesis, particularly for introducing protected amine functionalities with a bromine leaving group.

Loading RDKit molecule structure...
InChIKey: KHFDEFLMWSUKAS-UHFFFAOYSA-NC8H16BrNO2 | MW 238.12

Chemical Identity

Molecular Formula

C8H16BrNO2

Molecular Weight

238.12 g/mol

Exact Mass

237.03644

PubChem CID

14458310

IUPAC Name

tert-butyl N-(2-bromopropyl)carbamate

SMILES String

CC(Br)CNC(=O)OC(C)(C)C

Names & Synonyms

822-411-1N-Boc-2-bromo-1-propanamineCarbamic acid, (2-bromopropyl)-, 1,1-dimethylethyl esterKHFDEFLMWSUKAS-UHFFFAOYSA-Ntert-butyl(2-bromopropyl)carbamate
Show all synonyms
F387496
External Identifiers
RefChem:891581MFCD24167156SCHEMBL3526275WEA10288AKOS025243972AS-32501DA-47180SY028850CS-0442286EN300-1272499

Catalog Overview

Tert-butyl (2-bromopropyl)carbamate, with CAS 121102-88-3 and molecular formula C8H16BrNO2, is a key functionalized intermediate in synthetic chemistry. It features a tert-butyl carbamate (Boc) protecting group on an amine, alongside a bromine atom on the propyl chain. This bifunctional nature makes it highly valuable for various synthetic transformations, including nucleophilic substitution reactions to introduce new functionalities, or as a precursor in the synthesis of more complex molecules. Its Boc group provides amine protection, which can be selectively removed under acidic conditions, allowing for controlled reactivity in...

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Read more catalog context

Tert-butyl (2-bromopropyl)carbamate, with CAS 121102-88-3 and molecular formula C8H16BrNO2, is a key functionalized intermediate in synthetic chemistry. It features a tert-butyl carbamate (Boc) protecting group on an amine, alongside a bromine atom on the propyl chain. This bifunctional nature makes it highly valuable for various synthetic transformations, including nucleophilic substitution reactions to introduce new functionalities, or as a precursor in the synthesis of more complex molecules. Its Boc group provides amine protection, which can be selectively removed under acidic conditions, allowing for controlled reactivity in multi-step syntheses. This compound is intended for research use only.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White solid

Physical State

Solid

Melting Point

40.9 °C

Boiling Point

230.9 °C

Density

1.23 g/cm³

Water Solubility

0.0221 mol/L

Flash Point

133.8 °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 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. 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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