Description

(1R,6S)-3-Boc-3,7-Diazabicyclo[4.2.0]Octane CAS NO 1417789-72-0 is a high-purity, advanced pharmaceutical intermediate featuring a rigid diazabicyclic scaffold with a Boc-protected amine. This compound is critical for medicinal chemistry research and development, offering a versatile chiral building block for constructing complex molecules. It is primarily utilized by pharmaceutical R&D teams and fine chemical manufacturers engaged in the synthesis of novel active pharmaceutical ingredients (APIs), particularly in the areas of central nervous system (CNS) and antiviral therapeutics.

Application

• Pharmaceutical Intermediate: A key chiral synthon in the research and development of novel drug candidates, particularly for CNS disorders.
• Medicinal Chemistry: Used in structure-activity relationship (SAR) studies and lead optimization to introduce constrained bicyclic amine motifs.
• Protease Inhibitor Synthesis: Serves as a core scaffold in the development of inhibitors targeting various viral and human proteases.
• Asymmetric Synthesis: Employed as a chiral auxiliary or building block to induce stereoselectivity in complex multi-step syntheses.
• Chemical Biology: Utilized in the design and synthesis of molecular probes for studying enzyme function and receptor binding.
• Contract Research & Manufacturing (CRAM): Supplied to CDMOs for the cGMP production of clinical trial materials and commercial APIs.

Basic Information

Product Name	(1R,6S)-3-Boc-3,7-Diazabicyclo[4.2.0]Octane
CAS No.	1417789-72-0
Molecular Formula	C12H22N2O2
Molecular Weight	226.32 g/mol
Synonyms	(1R,6S)-3-(tert-Butoxycarbonyl)-3,7-diazabicyclo[4.2.0]octane; tert-Butyl (1R,6S)-3,7-diazabicyclo[4.2.0]octane-3-carboxylate; (1R,6S)-3-Boc-3,7-diazabicyclo[4.2.0]octane; Bicyclo[4.2.0]octane-3-carboxylic acid, 3,7-diaza-, 1,1-dimethylethyl ester, (1R,6S)-; (1R,6S)-3-Boc-7-aza-3-azabicyclo[4.2.0]octane; 1417789-72-0; (1R,6S)-Boc-DABCO derivative
EINECS	Contact for details

Quality Control

Our (1R,6S)-3-Boc-3,7-Diazabicyclo[4.2.0]Octane is manufactured under strict quality management systems. Each batch undergoes rigorous analytical testing, including chiral HPLC and NMR, to ensure identity, purity, and enantiomeric excess meet stringent specifications. Certificates of Analysis (COA) with full analytical data are provided for every shipment, supporting cGMP-compliant development workflows.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry place at 2-8°C or as specified on the label or COA. This material is hygroscopic (moisture-sensitive) and should be handled under inert atmosphere or in a controlled, dry environment to maintain stability.

Specification

Item	Specification
Appearance	White to off-white solid
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 98.0%
Chiral Purity (Chiral HPLC)	≥ 99.0% e.e.
Water Content (KF)	≤ 0.5%
Residual Solvents (GC)	Meets ICH Q3C guidelines

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