Cas no 7504-21-4 (8-phenylacenaphthyleno[1,2-d][1,3]thiazole)

8-phenylacenaphthyleno[1,2-d][1,3]thiazole structure
7504-21-4 structure
Product Name:8-phenylacenaphthyleno[1,2-d][1,3]thiazole
CAS No:7504-21-4
MF:C19H11NS
MW:285.362343072891
CID:981062
PubChem ID:346956
Update Time:2025-04-19

8-phenylacenaphthyleno[1,2-d][1,3]thiazole Chemical and Physical Properties

Names and Identifiers

    • 8-phenylacenaphthyleno[1,2-d][1,3]thiazole
    • AC1L865P
    • NSC405347
    • NSC-405347
    • 7504-21-4
    • DTXSID20323980
    • Inchi: 1S/C19H11NS/c1-2-6-13(7-3-1)19-20-17-14-10-4-8-12-9-5-11-15(16(12)14)18(17)21-19/h1-11H
    • InChI Key: ZVVKQBPHHSULIG-UHFFFAOYSA-N
    • SMILES: S1C(C2C=CC=CC=2)=NC2=C1C1C=CC=C3C=CC=C2C=13

Computed Properties

  • Exact Mass: 285.06133
  • Monoisotopic Mass: 285.06122
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 1
  • Complexity: 391
  • 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
  • Topological Polar Surface Area: 41.1
  • XLogP3: 5.3

Experimental Properties

  • Density: 1.359
  • Boiling Point: 483.4°C at 760 mmHg
  • Flash Point: 252.7°C
  • Refractive Index: 1.846
  • PSA: 12.89
  • LogP: 5.61070
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