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5-(4-Chlorobenzyl)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol(CAS: 125116-23-6)

5-(4-Chlorobenzyl)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol
CAS Number

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Basic Information

Molecular Formula
C17H22ClN3O
Molecular Weight
319.84 g/mol

Physical Properties

Melting Point
111.5°C
Boiling Point
285°C (rough estimate)
Flash Point
237.5°C

Chemical Identifiers

SMILES
CC1(CCC(C1(Cn2cncn2)O)Cc3ccc(cc3)Cl)C
InChIKey
XWPZUHJBOLQNMN-UHFFFAOYSA-N

Database References

MDL Number
MFCD01632341

FAQ

5-(4-Chlorobenzyl)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol is a crystalline solid with a molecular weight of approximately 310.13 g/mol. It has a low water solubility and moderate solubility in organic solvents. The compound is reactive towards nucleophiles and reducing agents. It can undergo substitution reactions and undergoes hydrolysis under basic conditions.
5-(4-Chlorobenzyl)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol can be synthesized through a multi-step process involving the coupling of a benzyl chloride derivative with a 2,2-dimethylcyclopentanol and a 1H-1,2,4-triazole. The reaction is typically carried out in the presence of a palladium catalyst, and the product is isolated and purified using chromatography techniques.
5-(4-Chlorobenzyl)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol is primarily used in pharmaceuticals for the development of novel drug candidates. It can also be used in the synthesis of polymers and as a precursor in the production of semiconductor materials. Additionally, it may find applications in the development of chemical sensors and other advanced materials.
When handling 5-(4-Chlorobenzyl)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol, it is essential to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. The compound should be handled in a well-ventilated area or a fume hood. Spills should be cleaned up immediately with appropriate absorbent materials. Always refer to a safety data sheet (SDS) for comprehensive information on handling and storage.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

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