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CAS 767-54-4

:

rel-(1R,5S)-3,3,5-Trimethylcyclohexanol

Description:
Rel-(1R,5S)-3,3,5-Trimethylcyclohexanol is a chiral alcohol characterized by its cyclohexane ring structure with three methyl groups attached at specific positions. The "rel" designation indicates that the compound has a specific stereochemistry, with the (1R,5S) configuration denoting the spatial arrangement of the substituents around the chiral centers. This compound is typically a colorless to pale yellow liquid at room temperature and possesses a characteristic odor. It is soluble in organic solvents and has limited solubility in water due to its hydrophobic nature. The presence of multiple methyl groups contributes to its steric bulk, influencing its reactivity and interactions with other molecules. As a secondary alcohol, it can undergo typical alcohol reactions, such as oxidation and dehydration. Its unique stereochemistry and structural features make it of interest in various fields, including organic synthesis and fragrance chemistry. Safety data should be consulted for handling, as with any chemical substance, to ensure proper precautions are taken.
Formula:C9H18O
InChI:InChI=1/C9H18O/c1-7-4-8(10)6-9(2,3)5-7/h7-8,10H,4-6H2,1-3H3/t7-,8-/s2
InChI key:InChIKey=BRRVXFOKWJKTGG-YZYOREDDNA-N
SMILES:CC1(C)C[C@H](C)C[C@@H](O)C1
Synonyms:
  • (1R,5S)-3,3,5-trimethylcyclohexanol
  • (1S,5R)-3,3,5-trimethylcyclohexanol
  • Cyclohexanol, 3,3,5-trimethyl-, trans-
  • rel-(1R,5S)-3,3,5-Trimethylcyclohexanol
  • trans-3,3,5-Trimethylcyclohexanol
  • trans-3,5,5-Trimethylcyclohexanol
  • Cyclohexanol, 3,3,5-trimethyl-, (1R,5S)-rel-
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