Description

(3-Iodo-Benzyl)-Methyl-Carbamic Acid tert-Butyl Ester is a high-purity, advanced pharmaceutical intermediate featuring a protected carbamate group and an iodine substituent. This compound is critical for medicinal chemistry research and development, particularly in the synthesis of novel active pharmaceutical ingredients (APIs) and targeted molecular probes. It is primarily utilized by pharmaceutical R&D laboratories, contract research organizations (CROs), and fine chemical manufacturers engaged in drug discovery programs, especially those focusing on structure-activity relationship (SAR) studies and radiolabeling precursors.

Application

• Pharmaceutical Intermediate: Key building block in the synthesis of complex drug candidates and active pharmaceutical ingredients (APIs).
• Medicinal Chemistry Research: Used in structure-activity relationship (SAR) studies to optimize drug potency and selectivity.
• Radiolabeling Precursor: The iodine atom serves as a potential site for radioiodination (e.g., with I-125 or I-131) for use in diagnostic imaging or radiopharmaceuticals.
• Chemical Biology Probe Development: Utilized in the creation of molecular probes for studying biological targets and pathways.
• Peptidomimetic Synthesis: Acts as a protected amino acid derivative in the construction of peptide-like molecules.
• Cross-Coupling Reactions: The aryl iodide moiety enables participation in key palladium-catalyzed cross-coupling reactions (e.g., Suzuki, Sonogashira) for molecular diversification.

Basic Information

Product Name	(3-Iodo-Benzyl)-Methyl-Carbamic Acid tert-Butyl Ester
CAS No.	954238-70-1
Molecular Formula	C13H18INO2
Molecular Weight	347.19 g/mol
Synonyms	tert-Butyl N-[(3-iodophenyl)methyl]-N-methylcarbamate; N-[(3-Iodobenzyl)-N-methyl]carbamic Acid 1,1-Dimethylethyl Ester; Boc-Protected 3-Iodo-N-Methylbenzylamine; N-Methyl-N-(3-iodobenzyl)carbamic Acid tert-Butyl Ester; 1,1-Dimethylethyl N-[(3-iodophenyl)methyl]-N-methylcarbamate; (3-Iodobenzyl)(methyl)carbamic Acid tert-Butyl Ester; tert-Butyl (3-Iodobenzyl)(methyl)carbamate
EINECS	Contact for details

Quality Control

Our (3-Iodo-Benzyl)-Methyl-Carbamic Acid tert-Butyl Ester is manufactured under strict quality management systems. Each batch undergoes rigorous analytical testing, including HPLC, NMR, and mass spectrometry, to ensure high chemical purity and identity confirmation. Certificates of Analysis (COA) with detailed specifications are provided for every shipment to guarantee batch-to-batch consistency and support your regulatory documentation needs.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at controlled room temperature (typically 15-25°C). Keep away from heat, open flames, and incompatible materials. For long-term storage, consider storing under an inert atmosphere to maintain optimal stability.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (HPLC)	Conforms
Identification (IR)	Conforms
Purity (HPLC)	≥ 97.0%
Water Content (KF)	≤ 0.5%
Residue on Ignition	≤ 0.1%

Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.