Cas no 1039-51-6 (Quinoline, 2,4-diphenyl-)

Quinoline, 2,4-diphenyl- structure
Quinoline, 2,4-diphenyl- structure
Product Name:Quinoline, 2,4-diphenyl-
CAS No:1039-51-6
MF:C21H15N
MW:281.350505113602
CID:1147159
PubChem ID:1822509
Update Time:2025-04-20

Quinoline, 2,4-diphenyl- Chemical and Physical Properties

Names and Identifiers

    • Quinoline, 2,4-diphenyl-
    • 2,4-diphenyl-quinoline
    • AKOS001354359
    • 1039-51-6
    • 2,4-diphenylquinoline
    • AE-641/00006013
    • CHEMBL1288035
    • Z227830898
    • SCHEMBL1042853
    • Inchi: 1S/C21H15N/c1-3-9-16(10-4-1)19-15-21(17-11-5-2-6-12-17)22-20-14-8-7-13-18(19)20/h1-15H
    • InChI Key: VCOKQFQTBUEGIO-UHFFFAOYSA-N
    • SMILES: N1C(C2C=CC=CC=2)=CC(C2C=CC=CC=2)=C2C=CC=CC=12

Computed Properties

  • Exact Mass: 281.12055
  • Monoisotopic Mass: 281.120449483g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 2
  • Complexity: 340
  • 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: 5.5
  • Topological Polar Surface Area: 12.9?2

Experimental Properties

  • PSA: 12.89
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