Cas no 102360-10-1 (1-(6-acetyl-1,5-dihydroxynaphthalen-2-yl)ethanone)

1-(6-acetyl-1,5-dihydroxynaphthalen-2-yl)ethanone structure
102360-10-1 structure
Product Name:1-(6-acetyl-1,5-dihydroxynaphthalen-2-yl)ethanone
CAS No:102360-10-1
MF:C14H12O4
MW:244.242684364319
CID:1134074
PubChem ID:15738175
Update Time:2025-04-20

1-(6-acetyl-1,5-dihydroxynaphthalen-2-yl)ethanone Chemical and Physical Properties

Names and Identifiers

    • 1-(6-acetyl-1,5-dihydroxynaphthalen-2-yl)ethanone
    • 102360-10-1
    • 1,1'-(1,5-Dihydroxynaphthalene-2,6-diyl)di(ethan-1-one)
    • DTXSID30577715
    • Inchi: 1S/C14H12O4/c1-7(15)9-3-5-12-11(13(9)17)6-4-10(8(2)16)14(12)18/h3-6,17-18H,1-2H3
    • InChI Key: GWMCITSKTPEWNQ-UHFFFAOYSA-N
    • SMILES: OC1C(C(C)=O)=CC=C2C(=C(C(C)=O)C=CC2=1)O

Computed Properties

  • Exact Mass: 244.07356
  • Monoisotopic Mass: 244.07355886g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 2
  • Complexity: 318
  • 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: 2.9
  • Topological Polar Surface Area: 74.6?2

Experimental Properties

  • PSA: 74.6
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