Description

Methyl (1S,2R,3R,8S)-4-Bromocubane-1-Carboxylate is a highly specialized, chiral brominated cubane derivative that serves as a critical advanced intermediate in organic synthesis. Its unique, highly strained cubane core and defined stereochemistry make it an invaluable building block for developing novel materials and pharmaceuticals with tailored properties. This compound is essential for researchers and process chemists in the pharmaceutical, agrochemical, and advanced materials sectors who require high-purity, structurally complex intermediates for cutting-edge R&D and process development.

Application

• Pharmaceutical Intermediate: A key chiral synthon for the research and development of new active pharmaceutical ingredients (APIs), particularly those targeting central nervous system (CNS) disorders or requiring rigid, three-dimensional scaffolds.
• Agrochemical Research: Used in the synthesis of novel crop protection agents and herbicides, where the cubane structure can impart unique biological activity and environmental stability.
• Advanced Materials Synthesis: Serves as a precursor for high-energy-density materials (HEDMs) and specialty polymers, leveraging the high strain energy and thermal stability of the cubane framework.
• Ligand and Catalyst Development: Employed in the creation of novel chiral ligands and organocatalysts for asymmetric synthesis, benefiting from its precise stereochemistry.
• Academic and Industrial R&D: A valuable tool for fundamental studies in synthetic methodology, physical organic chemistry, and the exploration of structure-property relationships.

Basic Information

Product Name	Methyl (1S,2R,3R,8S)-4-Bromocubane-1-Carboxylate
CAS No.	37794-28-8
Molecular Formula	C11H13BrO2
Molecular Weight	257.12 g/mol
Synonyms	Methyl 4-Bromocubane-1-carboxylate; (1S,2R,3R,8S)-Methyl 4-Bromocubane-1-Carboxylate; 4-Bromocubane-1-carboxylic Acid Methyl Ester; Methyl 4-Bromopentacyclo[4.2.0.02,5.03,8.04,7]octane-1-carboxylate; Bromocubane Methyl Ester; Cubane Bromo Ester; (1S,2R,3R,8S)-Rel-Methyl 4-Bromocubane-1-Carboxylate
EINECS	Contact for details

Quality Control

Every batch of Methyl (1S,2R,3R,8S)-4-Bromocubane-1-Carboxylate is produced and analyzed under strict quality management protocols to ensure the highest standards of purity, identity, and stereochemical integrity. Our products undergo rigorous quality testing, including chiral HPLC and NMR spectroscopy, to ensure compliance with exacting R&D and process chemistry requirements. Certificates of Analysis (COA) detailing purity, chiral excess, and impurity profiles are available upon request.

Storage

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

Specification

Item	Specification
Appearance	White to off-white crystalline solid
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Chiral Purity (Chiral HPLC)	≥ 98.0% ee
Melting Point	Contact for details
Heavy Metals	< 20 ppm
Residual Solvents (GC)	Complies with ICH guidelines

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