Cas no 6169-89-7 (1H-Phenanthro[2,1-C]pyran-1,3(4H)-dione)

1H-Phenanthro[2,1-C]pyran-1,3(4H)-dione structure
6169-89-7 structure
Product Name:1H-Phenanthro[2,1-C]pyran-1,3(4H)-dione
CAS No:6169-89-7
MF:C17H10O3
MW:262.259504795074
CID:2727044
PubChem ID:57351553
Update Time:2025-04-21

1H-Phenanthro[2,1-C]pyran-1,3(4H)-dione Chemical and Physical Properties

Names and Identifiers

    • 4H-naphtho[2,1-f]isochromene-1,3-dione
    • 6169-89-7
    • DTXSID00722371
    • 1H-PHENANTHRO[2,1-C]PYRAN-1,3(4H)-DIONE
    • 1H-Phenanthro[2,1-C]pyran-1,3(4H)-dione
    • Inchi: 1S/C17H10O3/c18-16-9-15-13-6-5-10-3-1-2-4-11(10)12(13)7-8-14(15)17(19)20-16/h1-8H,9H2
    • InChI Key: BUQNBSURLLQWPO-UHFFFAOYSA-N
    • SMILES: O1C(CC2C(C1=O)=CC=C1C3C=CC=CC=3C=CC=21)=O

Computed Properties

  • Exact Mass: 262.062994177Da
  • Monoisotopic Mass: 262.062994177Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 0
  • Complexity: 430
  • 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: 3.7
  • Topological Polar Surface Area: 43.4?2
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