Cas no 39572-18-4 (Ethanone,1-[4-(3-pyridinyloxy)phenyl]-)

Ethanone,1-[4-(3-pyridinyloxy)phenyl]- structure
39572-18-4 structure
Product Name:Ethanone,1-[4-(3-pyridinyloxy)phenyl]-
CAS No:39572-18-4
MF:C13H11NO2
MW:213.231943368912
CID:317781
PubChem ID:3016094
Update Time:2025-04-19

Ethanone,1-[4-(3-pyridinyloxy)phenyl]- Chemical and Physical Properties

Names and Identifiers

    • Ethanone,1-[4-(3-pyridinyloxy)phenyl]-
    • 1-(4-pyridin-3-yloxyphenyl)ethanone
    • 1-(4-(Pyridin-3-yloxy)phenyl)ethan-1-one
    • 1-[4-(pyridin-3-yloxy)phenyl]ethanone
    • 39572-18-4
    • Ethanone, 1-[4-(3-pyridinyloxy)phenyl]-
    • 1-[4-((pyridin-3-yl)oxy)phenyl]ethan-1-one
    • CLOBDYGKUVCMRD-UHFFFAOYSA-N
    • GK332S8DJ4
    • SCHEMBL4085591
    • 1-[4-(3-Pyridinyloxy)phenyl]ethanone
    • DTXSID00192691
    • 1-(4-(Pyridin-3-yloxy)phenyl)ethanone
    • NS00030612
    • EINECS 254-527-8
    • Inchi: 1S/C13H11NO2/c1-10(15)11-4-6-12(7-5-11)16-13-3-2-8-14-9-13/h2-9H,1H3
    • InChI Key: CLOBDYGKUVCMRD-UHFFFAOYSA-N
    • SMILES: O(C1C=NC=CC=1)C1C=CC(C(C)=O)=CC=1

Computed Properties

  • Exact Mass: 213.07903
  • Monoisotopic Mass: 213.078978594g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 234
  • 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: 2.1
  • Topological Polar Surface Area: 39.2?2

Experimental Properties

  • PSA: 39.19
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