Cas no 1701-33-3 (Quinoline,4-azido-2-(trifluoromethyl)-)

Quinoline,4-azido-2-(trifluoromethyl)- structure
1701-33-3 structure
Product Name:Quinoline,4-azido-2-(trifluoromethyl)-
CAS No:1701-33-3
MF:C10H5F3N4
MW:238.168711423874
CID:223455
PubChem ID:3384600
Update Time:2025-04-19

Quinoline,4-azido-2-(trifluoromethyl)- Chemical and Physical Properties

Names and Identifiers

    • Quinoline,4-azido-2-(trifluoromethyl)-
    • 4-azido-2-(trifluoromethyl)quinoline
    • AC1MPFY2
    • NSC128777
    • NSC-128777
    • 1701-33-3
    • DTXSID70391992
    • Inchi: 1S/C10H5F3N4/c11-10(12,13)9-5-8(16-17-14)6-3-1-2-4-7(6)15-9/h1-5H
    • InChI Key: UPRGFOMBBCDMID-UHFFFAOYSA-N
    • SMILES: FC(C1=CC(=C2C=CC=CC2=N1)N=[N+]=[N-])(F)F

Computed Properties

  • Exact Mass: 238.04700
  • Monoisotopic Mass: 238.04663066g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 1
  • Complexity: 324
  • 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
  • Topological Polar Surface Area: 27.2?2

Experimental Properties

  • PSA: 62.64000
  • LogP: 3.64816
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