Cas no 5325-19-9 (Naphtho[2,3-d]thiazole,2-phenyl-)

Naphtho[2,3-d]thiazole,2-phenyl- structure
5325-19-9 structure
Product Name:Naphtho[2,3-d]thiazole,2-phenyl-
CAS No:5325-19-9
MF:C17H11NS
MW:261.340942621231
CID:379231
PubChem ID:219186
Update Time:2025-04-19

Naphtho[2,3-d]thiazole,2-phenyl- Chemical and Physical Properties

Names and Identifiers

    • Naphtho[2,3-d]thiazole,2-phenyl-
    • 2-phenylbenzo[f][1,3]benzothiazole
    • AC1L5684
    • AC1Q4WIB
    • CTK4J7357
    • NSC129
    • NSC-129
    • Naphtho[2, 2-phenyl-
    • DTXSID20276967
    • SCHEMBL24466846
    • 5325-19-9
    • Inchi: 1S/C17H11NS/c1-2-6-12(7-3-1)17-18-15-10-13-8-4-5-9-14(13)11-16(15)19-17/h1-11H
    • InChI Key: CYVZJVLKLDQVRY-UHFFFAOYSA-N
    • SMILES: S1C(C2C=CC=CC=2)=NC2C=C3C=CC=CC3=CC1=2

Computed Properties

  • Exact Mass: 261.06133
  • Monoisotopic Mass: 261.061
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 1
  • Complexity: 312
  • 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: 4.9
  • Topological Polar Surface Area: 41.1?2

Experimental Properties

  • Density: 1.27
  • Boiling Point: 453.5°C at 760 mmHg
  • Flash Point: 234.5°C
  • Refractive Index: 1.74
  • PSA: 12.89
  • LogP: 5.11650
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