Cas no 72712-21-1 ((5-acetyl-2-acetyloxy-phenyl) acetate)

(5-Acetyl-2-acetyloxy-phenyl) acetate is a versatile aromatic ester compound characterized by its acetyl and acetyloxy functional groups. This structure imparts reactivity suitable for applications in organic synthesis, particularly as an intermediate in the production of pharmaceuticals, fragrances, or specialty chemicals. The presence of multiple acetyl groups enhances its utility in acyl transfer reactions or as a protecting group in multistep syntheses. Its stability under controlled conditions and well-defined molecular architecture make it a reliable reagent for precision chemical transformations. The compound’s purity and consistent performance are critical for research and industrial processes requiring high reproducibility. Proper handling and storage are recommended to maintain its integrity.
(5-acetyl-2-acetyloxy-phenyl) acetate structure
72712-21-1 structure
Product Name:(5-acetyl-2-acetyloxy-phenyl) acetate
CAS No:72712-21-1
MF:C12H12O5
MW:236.220684051514
CID:578148
PubChem ID:3854540
Update Time:2025-06-23

(5-acetyl-2-acetyloxy-phenyl) acetate Chemical and Physical Properties

Names and Identifiers

    • (5-acetyl-2-acetyloxy-phenyl) acetate
    • (4-acetyl-2-acetyloxyphenyl) acetate
    • ACETIC ACID 2-ACETOXY-5-ACETYL-PHENYL ESTER
    • 1-(3,4-Diacetoxy-phenyl)-aethanon
    • 1-(3,4-diacetoxy-phenyl)-ethanone
    • 3,4-Diacetoxy-acetophenon
    • 3,4-diacetoxyacetophenone
    • AC1MYCGU
    • AC1Q1LA4
    • AG-G-86427
    • CTK2I0667
    • SureCN6550416
    • 72712-21-1
    • SCHEMBL6550416
    • AKOS000121684
    • 4-Acetyl-1,2-phenylene diacetate
    • CS-0278884
    • 5-(4-CHLORO-PHENYLSULFAMOYL)-2-HYDROXY-BENZOICACID
    • EN300-01105
    • 5-acetyl-2-(acetyloxy)phenyl acetate
    • DTXSID00397381
    • Inchi: 1S/C12H12O5/c1-7(13)10-4-5-11(16-8(2)14)12(6-10)17-9(3)15/h4-6H,1-3H3
    • InChI Key: DBRDKWNUFUAJKH-UHFFFAOYSA-N
    • SMILES: O(C(C)=O)C1C=C(C(C)=O)C=CC=1OC(C)=O

Computed Properties

  • Exact Mass: 236.06846
  • Monoisotopic Mass: 236.06847348g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 5
  • Complexity: 323
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.1
  • Topological Polar Surface Area: 69.7?2

Experimental Properties

  • PSA: 69.67

(5-acetyl-2-acetyloxy-phenyl) acetate Pricemore >>

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