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Tert-butyl (1-iodopropan-2-yl)carbamate

CAS 363599-44-4Formula C8H16INO2MW 285.12PubChem 21592606

Tert-butyl (1-iodopropan-2-yl)carbamate is a functionalized intermediate featuring a Boc-protected amine and an iodine atom, primarily utilized in organic synthesis as a versatile building block for introducing complex structures.

Loading RDKit molecule structure...
InChIKey: CUKVINMIOAQKNB-UHFFFAOYSA-NC8H16INO2 | MW 285.12

Chemical Identity

Molecular Formula

C8H16INO2

Molecular Weight

285.12 g/mol

Exact Mass

285.02258

PubChem CID

21592606

IUPAC Name

tert-butyl N-(1-iodopropan-2-yl)carbamate

SMILES String

CC(CI)NC(=O)OC(C)(C)C

Names & Synonyms

2-(Boc-amino)-1-iodopropane(2-Iodo-1-methyl-ethyl)-carbamic acid tert-butyl esterC8H16INO2tert-Butyl (2-iodo-1-methylethyl)carbamatet-Butyl (1-iodopropan-2-yl)carbamate
Show all synonyms
tert-butyl(1-iodopropan-2-yl)carbamateF200262-Methyl-2-propanyl (1-iodo-2-propanyl)carbamate
External Identifiers
MFCD17214622SCHEMBL28966590AKOS024262031SB34045SB36842SB37218SY028007DB-257558CS-0342186

Catalog Overview

Tert-butyl (1-iodopropan-2-yl)carbamate, identified by CAS 363599-44-4 and molecular formula C8H16INO2, is a valuable research-use chemical. It features a tert-butyl carbamate (Boc) protecting group for an amine and an iodo-substituted propane chain. This bifunctional nature makes it a key intermediate in organic synthesis, particularly in pharmaceutical and agrochemical research. The iodine atom serves as a reactive site for nucleophilic substitution, cross-coupling reactions, or further derivatization, while the Boc group allows for selective manipulation of the amine functionality.

Use Context

  • Research chemical sourcing
  • Custom synthesis and catalog availability review
  • COA, SDS, pricing, and fulfillment workflow

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White to off-white solid

Physical State

Solid

Melting Point

65.0 °C

Boiling Point

290.0 °C

Density

1.45 g/cm³

Water Solubility

Slightly soluble

Flash Point

165.0 °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 (PPE) including gloves, eye protection, and a lab coat. Use in a well-ventilated area or fume hood to avoid inhalation. Avoid direct contact with skin and eyes. Store in a cool, dry place, away from incompatible materials. Consult the Safety Data Sheet (SDS) for detailed safety information before use.

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