CAS 2161-85-5

4,6-Diacetylresorcinol

Description:

4,6-Diacetylresorcinol, with the CAS number 2161-85-5, is an organic compound that belongs to the class of resorcinols, which are dihydroxybenzene derivatives. This compound features two acetyl groups attached to the 4 and 6 positions of the resorcinol structure. It is typically a white to pale yellow crystalline solid that is soluble in organic solvents such as ethanol and acetone, but has limited solubility in water. 4,6-Diacetylresorcinol is known for its applications in various fields, including as a reagent in organic synthesis and as a potential intermediate in the production of dyes and pharmaceuticals. It exhibits antioxidant properties and has been studied for its potential biological activities, including antimicrobial effects. The compound's melting point and boiling point can vary based on purity and environmental conditions. As with many chemical substances, proper handling and safety precautions are essential due to its potential health effects.

Formula: C₁₀H₁₀O₄

InChI: InChI=1S/C10H10O4/c1-5(11)7-3-8(6(2)12)10(14)4-9(7)13/h3-4,13-14H,1-2H3

InChI key: InChIKey=GEYCQLIOGQPPFM-UHFFFAOYSA-N

SMILES: C(C)(=O)C1=CC(C(C)=O)=C(O)C=C1O

Synonyms:

• 1,1'-(4,6-Dihydroxybenzene-1,3-Diyl)Diethanone
• 1,1-(4,6-Dihydroxy-1,3-phenylene)bisethanone
• 1,1′-(4,6-Dihydroxy-1,3-phenylene)diethanone
• 1,3-Diacetyl-4,6-dihydroxybenzene
• 1,5-Diacetyl-2,4-dihydroxybenzene
• 1-(5-Acetyl-2,4-dihydroxyphenyl)ethan-1-one
• 1-(5-Acetyl-2,4-dihydroxyphenyl)ethanone
• 2′,4′-Dihydroxy-5′-acetylacetophenone
• 4,6-Diacetyl-1,3-benzenediol
• 4,6-Diacetylresorcinol
• 5′-Acetyl-2′,4′-dihydroxyacetophenone
• Ethanone, 1,1′-(4,6-dihydroxy-1,3-phenylene)bis-
• Resdiacetophenone
• Resodiacetophenone
• Resorcinol, 4,6-diacetyl-

4,6-DIACETYLRESORCINOL

CAS: 2161-85-5

Formula: C₁₀H₁₀O₄

Purity: 98%

Color and Shape: Solid

Molecular weight: 194.1840

Ref: IN-DA003KIW

1-(5-acetyl-2,4-dihydroxyphenyl)ethan-1-one

CAS: 2161-85-5

1-(5-acetyl-2,4-dihydroxyphenyl)ethan-1-one

Purity: 99%

Molecular weight: 194.18399g/mol

Ref: 54-OR21973

4,6-Diacetylresorcinol

CAS: 2161-85-5

Formula: C₁₀H₁₀O₄

Purity: >98.0%(GC)(T)

Color and Shape: White to Gray to Brown powder to crystal

Molecular weight: 194.19

Ref: 3B-D5102

4,6-Diacetylresorcinol

CAS: 2161-85-5

4,6-Diacetylresorcinol is a tetradentate ligand that can be used for the palladium-catalyzed hydrogenation of phenols. The compound has been shown to have anticancer activity and was found to be selective against cancer cell lines. It also inhibits the growth of staphylococcus bacteria in biological studies. 4,6-Diacetylresorcinol is thermodynamically stable and has a high binding affinity with nitrogen nucleophiles such as amines and anilines. Molecular modeling studies show that the nitrogen atoms are located near the center of the molecule, making them accessible for intramolecular hydrogen transfer reactions.

Formula: C₁₀H₁₀O₄

Purity: Min. 95%

Color and Shape: Powder

Molecular weight: 194.18 g/mol

Ref: 3D-FD54291

1,1′-(4,6-Dihydroxy-1,3-phenylene)-bis-ethanone

CAS: 2161-85-5

Formula: C₁₀H₁₀O₄

Purity: 98%

Color and Shape: Solid

Molecular weight: 194.186

Ref: 10-F012078