CAS 216752-89-5

1,4-Bis[(4-hydroxyphenyl)methyl] (2R)-2-hydroxy-2-(2-methylpropyl)butanedioate

Description:

1,4-Bis[(4-hydroxyphenyl)methyl] (2R)-2-hydroxy-2-(2-methylpropyl)butanedioate, identified by its CAS number 216752-89-5, is a chemical compound characterized by its complex structure featuring multiple functional groups. It contains two hydroxyphenyl groups, which contribute to its potential as a phenolic compound, and a butanedioate moiety that suggests the presence of carboxylic acid derivatives. The compound's stereochemistry is indicated by the (2R) designation, suggesting specific spatial arrangements that can influence its reactivity and interactions. This substance may exhibit properties typical of both phenolic compounds and carboxylates, such as antioxidant activity or the ability to form hydrogen bonds. Its potential applications could span various fields, including pharmaceuticals, materials science, and organic synthesis, where its unique structural features may be leveraged for specific chemical reactions or as intermediates in the synthesis of more complex molecules. However, detailed studies would be necessary to fully elucidate its physical and chemical properties, as well as its biological activities.

Formula: C₂₂H₂₆O₇

InChI: InChI=1S/C22H26O7/c1-15(2)11-22(27,21(26)29-14-17-5-9-19(24)10-6-17)12-20(25)28-13-16-3-7-18(23)8-4-16/h3-10,15,23-24,27H,11-14H2,1-2H3/t22-/m1/s1

InChI key: InChIKey=IKKNRVAESCIIGG-JOCHJYFZSA-N

SMILES: [C@](C(OCC1=CC=C(O)C=C1)=O)(CC(OCC2=CC=C(O)C=C2)=O)(CC(C)C)O

Synonyms:

• Butanedioic acid, 2-hydroxy-2-(2-methylpropyl)-, bis[(4-hydroxyphenyl)methyl] ester, (2R)-
• Habenariol
• Butanedioic acid, 2-hydroxy-2-(2-methylpropyl)-, 1,4-bis[(4-hydroxyphenyl)methyl] ester, (2R)-
• 1,4-Bis[(4-hydroxyphenyl)methyl] (2R)-2-hydroxy-2-(2-methylpropyl)butanedioate

Habenariol

CAS: 216752-89-5

Habenariol is a substance isolated from the freshwater orchid Habenaria repens, characterized by its significant phenolic antioxidant activity.

Formula: C₂₂H₂₆O₇

Color and Shape: Solid

Molecular weight: 402.44

Ref: TM-TN8314