Description

Butanoic Acid, (1R,5R)-3,3,5-Trimethylcyclohexyl Ester, Rel- (9Ci) is a high-purity, stereochemically defined ester compound with the CAS registry number 828912-41-0. This specialty chemical is valued for its specific molecular configuration, which is critical for applications requiring precise chiral properties and consistent performance. It serves as a key intermediate or building block for advanced synthesis in the pharmaceutical, agrochemical, and fine chemical industries, where molecular specificity directly impacts product efficacy and quality.

Application

• Pharmaceutical Intermediate: Used in the synthesis of active pharmaceutical ingredients (APIs) where the specific (1R,5R) stereochemistry is required for biological activity.
• Agrochemical Synthesis: Serves as a chiral building block for developing advanced pesticides and herbicides with targeted action.
• Fine Chemical Production: Employed in the manufacture of specialty chemicals, including flavors, fragrances, and advanced materials.
• Research & Development: A valuable reference standard and starting material in organic chemistry and medicinal chemistry research for exploring new synthetic pathways.
• Polymer Modification: Can be utilized as a monomer or modifier to impart specific properties to polymeric materials.

Basic Information

Product Name	Butanoic Acid, (1R,5R)-3,3,5-Trimethylcyclohexyl Ester, Rel- (9Ci)
CAS No.	828912-41-0
Molecular Formula	C13H24O2
Molecular Weight	212.33 g/mol
Synonyms	(1R,5R)-3,3,5-Trimethylcyclohexyl Butyrate; rel-(1R,5R)-3,3,5-Trimethylcyclohexyl Butanoate; Butanoic Acid (1R,5R)-3,3,5-Trimethylcyclohexyl Ester; (1R,5R)-3,3,5-Trimethylcyclohexyl Butanoate; Butyric Acid (1R,5R)-3,3,5-Trimethylcyclohexyl Ester; CAS 828912-41-0
EINECS	Contact for details

Quality Control

Our Butanoic Acid, (1R,5R)-3,3,5-Trimethylcyclohexyl Ester, Rel- (9Ci) is produced under strict quality management systems. Every batch undergoes comprehensive analytical testing, including chiral purity analysis by HPLC and GC, to ensure it meets the high standards required for advanced synthetic applications. A detailed Certificate of Analysis (COA) is provided with each shipment, confirming identity, purity, and compliance with agreed specifications.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, well-ventilated area at controlled room temperature (15-25°C). Keep away from strong bases and incompatible materials such as strong oxidizing agents. For long-term storage, consider under an inert atmosphere to maintain optimal purity.

Specification

Item	Specification
Appearance	Colorless to pale yellow liquid
Identification (IR)	Conforms to structure
Assay (GC/HPLC)	≥ 98.0%
Chiral Purity (Chiral HPLC)	≥ 99.0% de (for specified isomer)
Water Content (KF)	≤ 0.5%

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