Cas no 13474-48-1 (1-phenyl-2-pyridin-2-ylethane-1,2-dione)

1-phenyl-2-pyridin-2-ylethane-1,2-dione structure
13474-48-1 structure
Product Name:1-phenyl-2-pyridin-2-ylethane-1,2-dione
CAS No:13474-48-1
MF:C13H9NO2
MW:211.216063261032
CID:1243305
PubChem ID:251601
Update Time:2025-04-20

1-phenyl-2-pyridin-2-ylethane-1,2-dione Chemical and Physical Properties

Names and Identifiers

    • 1-phenyl-2-pyridin-2-ylethane-1,2-dione
    • CTK0I1008
    • AC1L5K7E
    • 1-Phenyl-2-(pyridin-2-yl)-1,2-ethanedione
    • AR-1C5200
    • NSC72180
    • NCIOpen2_003749
    • 1-Phenyl-2-(2-pyridyl)ethanedione
    • 1-phenyl-2-pyridin-2-yl-ethane-1,2-dione
    • phenyl-pyridin-2-yl-ethanedione
    • 1-(Pyrid-2-yl)-2-phenyl-1,2-ethanedione
    • AC1Q5BUS
    • SureCN5012058
    • 1-phenyl-2-(2-pyridyl)-1,2-ethanedione
    • 1-phenyl-2-(pyridin-2-yl)ethane-1,2-dione
    • 1-phenyl-2-(2-pyridinyl)ethane-1,2-dione
    • CTK0I1008; AC1L5K7E; 1-Phenyl-2-(pyridin-2-yl)-1,2-ethanedione; AR-1C5200; NSC72180; NCIOpen2_003749; 1-Phenyl-2-(2-pyridyl)ethanedione; 1-phenyl-2-pyridin-2-yl-ethane-1,2-dione; phenyl-pyridin-2-yl-ethanedione; 1-(Pyrid-2-yl)-2-phenyl-1,2-ethanedione; AC1Q5BUS; SureCN5012058; 1-phenyl-2-(2-pyridyl)-1,2-ethanedione; 1-phenyl-2-(pyridin-2-yl)ethane-1,2-dione; 1-phenyl-2-(2-pyridinyl)ethane-1,2-dione;
    • 1-Phenyl-2-(2-pyridinyl)-1,2-ethanedione #
    • 13474-48-1
    • NSC-72180
    • SCHEMBL5012058
    • DTXSID70290976
    • 1-phenyl-2-(2-pyridyl)ethane-1,2-dione
    • 1 -phenyl-2-(2-pyridinyl)ethanedione
    • Inchi: 1S/C13H9NO2/c15-12(10-6-2-1-3-7-10)13(16)11-8-4-5-9-14-11/h1-9H
    • InChI Key: YJHZXKQYHAYVOU-UHFFFAOYSA-N
    • SMILES: O=C(C(C1C=CC=CN=1)=O)C1C=CC=CC=1

Computed Properties

  • Exact Mass: 211.06337
  • Monoisotopic Mass: 211.063328530g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 269
  • 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: 2.2
  • Topological Polar Surface Area: 47?2

Experimental Properties

  • PSA: 47.03
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