Cas no 948292-54-4 ( )

  structure
  structure
Product Name: 
CAS No:948292-54-4
MF:C11H9F3N2
MW:226.197772741318
CID:869485
PubChem ID:17039845
Update Time:2025-04-19

  Chemical and Physical Properties

Names and Identifiers

    • 2-methyl-6-(trifluoromethyl)quinolin-4-amine
    • 4-AMINO-2-METHYL-6-TRIFLUOROMETHYLQUINOLINE
    • 2-Methyl-6-trifluoromethyl-quinolin-4-ylamine
    • BB 0241064
    • 948292-54-4
    • NSNCJGFDMIRSNJ-UHFFFAOYSA-N
    • AKOS005199579
    • SCHEMBL437638
    • AB52032
    • MFCD09787702
    • DTXSID60589028
    •  
    • Inchi: 1S/C11H9F3N2/c1-6-4-9(15)8-5-7(11(12,13)14)2-3-10(8)16-6/h2-5H,1H3,(H2,15,16)
    • InChI Key: NSNCJGFDMIRSNJ-UHFFFAOYSA-N
    • SMILES: FC(C1C=CC2C(C=1)=C(C=C(C)N=2)N)(F)F

Computed Properties

  • Exact Mass: 226.07200
  • Monoisotopic Mass: 226.07178278g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 0
  • Complexity: 254
  • 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: 2.8
  • Topological Polar Surface Area: 38.9?2

Experimental Properties

  • PSA: 38.91000
  • LogP: 3.72540
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