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CAS 97996-39-9

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Cyclohexanol, 5-methyl-2-(1-methylethyl)-, triester with boric acid (H3BO3), (1S,1′S,1′′S,2S,2′S,2′′S,5S,5′S,5′′S)-

Description:
Cyclohexanol, 5-methyl-2-(1-methylethyl)-, triester with boric acid, identified by CAS number 97996-39-9, is an organic compound characterized by its ester functional groups formed from the reaction of cyclohexanol derivatives with boric acid. This compound features a cyclohexanol backbone with a branched alkyl substituent, which contributes to its unique physical and chemical properties. Typically, esters exhibit moderate polarity, which influences their solubility in various solvents, and they often have distinctive odors. The presence of boron in the structure may impart specific reactivity, particularly in coordination chemistry and potential applications in materials science. The stereochemistry indicated by the (1S,1′S,1′′S,2S,2′S,2′′S,5S,5′S,5′′S) notation suggests a specific three-dimensional arrangement of atoms, which can affect the compound's biological activity and interaction with other molecules. Overall, this compound may have applications in fields such as organic synthesis, pharmaceuticals, or as a potential additive in various chemical processes.
Formula:C30H57BO3
InChI:InChI=1/C30H57BO3/c1-19(2)25-13-10-22(7)16-28(25)32-31(33-29-17-23(8)11-14-26(29)20(3)4)34-30-18-24(9)12-15-27(30)21(5)6/h19-30H,10-18H2,1-9H3/t22-,23-,24-,25-,26-,27-,28-,29-,30-/s2
InChI key:InChIKey=APDCUDTVQNGARJ-MJIQZLGRNA-N
SMILES:[C@H](C)(C)[C@H]1[C@@H](OB(O[C@@H]2[C@H]([C@@H](C)C)CC[C@H](C)C2)O[C@@H]3[C@H]([C@H](C)C)CC[C@H](C)C3)C[C@@H](C)CC1
Synonyms:
  • Cyclohexanol, 5-methyl-2-(1-methylethyl)-, triester with boric acid (H3BO3), stereoisomer
  • Cyclohexanol, 5-methyl-2-(1-methylethyl)-, triester with boric acid (H3BO3), (1S,1′S,1′′S,2S,2′S,2′′S,5S,5′S,5′′S)-
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