Cas no 57374-16-0 (2,9-Anthracenediol, 10-[4-(acetyloxy)phenyl]-, diacetate)

2,9-Anthracenediol, 10-[4-(acetyloxy)phenyl]-, diacetate structure
57374-16-0 structure
Product Name:2,9-Anthracenediol, 10-[4-(acetyloxy)phenyl]-, diacetate
CAS No:57374-16-0
MF:C26H24O8
MW:464.463968276978
CID:345572
PubChem ID:71444166
Update Time:2025-04-19

2,9-Anthracenediol, 10-[4-(acetyloxy)phenyl]-, diacetate Chemical and Physical Properties

Names and Identifiers

    • 2,9-Anthracenediol, 10-[4-(acetyloxy)phenyl]-, diacetate
    • acetic acid,[4-(3,10-dihydroxyanthracen-9-yl)phenyl] acetate
    • DTXSID40852964
    • Acetic acid--4-(3,10-dihydroxyanthracen-9-yl)phenyl acetate (2/1)
    • 57374-16-0
    • Inchi: 1S/C22H16O4.2C2H4O2/c1-13(23)26-16-9-6-14(7-10-16)21-17-4-2-3-5-19(17)22(25)20-12-15(24)8-11-18(20)21;2*1-2(3)4/h2-12,24-25H,1H3;2*1H3,(H,3,4)
    • InChI Key: OCFYUHXQFPVONI-UHFFFAOYSA-N
    • SMILES: OC1C2C=CC=CC=2C(C2C=CC(=CC=2)OC(C)=O)=C2C=CC(=CC2=1)O.OC(C)=O.OC(C)=O

Computed Properties

  • Exact Mass: 464.14712
  • Monoisotopic Mass: 464.14711772g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 34
  • Rotatable Bond Count: 3
  • Complexity: 529
  • Covalently-Bonded Unit Count: 3
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 141?2

Experimental Properties

  • PSA: 141.36
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