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tert-butyl N-(3-bromo-2,2-dimethylpropyl)carbamate

CAS 1397707-56-0Formula C10H20BrNO2MW 266.18PubChem 115364893

tert-butyl N-(3-bromo-2,2-dimethylpropyl)carbamate is a bromo-substituted carbamate derivative, primarily utilized as a versatile building block in organic synthesis. Its structure features a tert-butyl carbamate protecting group and a bromine atom, making it suitable for various coupling reactions and further functionalization in research and development.

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InChIKey: AGIDVDMCVNOYCM-UHFFFAOYSA-NC10H20BrNO2 | MW 266.18

Chemical Identity

Molecular Formula

C10H20BrNO2

Molecular Weight

266.18 g/mol

Exact Mass

265.06774

PubChem CID

115364893

SMILES String

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

Names & Synonyms

860-534-2tert-Butyl (3-bromo-2,2-dimethylpropyl)carbamatetert-Butyl(3-bromo-2,2-dimethylpropyl)carbamateN-Boc-3-bromo-2,2-dimethyl-1-propanamineI10677
Show all synonyms
F784923tert-butyl N-(3-bromo-2,2-dimethyl-propyl)carbamate
External Identifiers
RefChem:895931MFCD24188767XFC70756SY201567DB-432656EN300-212324

Catalog Overview

tert-butyl N-(3-bromo-2,2-dimethylpropyl)carbamate, with CAS number 1397707-56-0, is an organic compound characterized by a tert-butyl carbamate (Boc) protecting group on a primary amine and a bromine atom on a neopentyl-like carbon chain. This bifunctional nature makes it a valuable intermediate in synthetic chemistry. The Boc group offers protection for the amine functionality during multi-step syntheses, while the bromine atom serves as a reactive site for nucleophilic substitution, Grignard reactions, or palladium-catalyzed cross-coupling reactions such as Suzuki, Heck, or Sonogashira couplings. Researchers can leverage this...

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tert-butyl N-(3-bromo-2,2-dimethylpropyl)carbamate, with CAS number 1397707-56-0, is an organic compound characterized by a tert-butyl carbamate (Boc) protecting group on a primary amine and a bromine atom on a neopentyl-like carbon chain. This bifunctional nature makes it a valuable intermediate in synthetic chemistry. The Boc group offers protection for the amine functionality during multi-step syntheses, while the bromine atom serves as a reactive site for nucleophilic substitution, Grignard reactions, or palladium-catalyzed cross-coupling reactions such as Suzuki, Heck, or Sonogashira couplings. Researchers can leverage this compound for the synthesis of complex molecules, including pharmaceuticals, agrochemicals, and materials, where precise control over functional group transformations is required. Its molecular formula is C10H20BrNO2 and its molecular weight is 266.18 g/mol.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

white crystalline solid

Physical State

solid

Melting Point

43.1 °C

Boiling Point

265.5 °C

Density

1.19 g/cm³

Water Solubility

1.6 × 10⁻³ mol/L

Flash Point

127.4 °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-bromo-2,2-dimethylpropyl)carbamate in a well-ventilated fume hood. Wear appropriate personal protective equipment, including safety goggles, gloves, and a lab coat. Avoid inhalation, ingestion, and skin contact. In case of contact, wash thoroughly with soap and water. Store in a cool, dry place, away from incompatible materials. Consult the Safety Data Sheet (SDS) for detailed hazard information and handling precautions.

Related Products / Graph Discovery

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