Cas no 819052-91-0 ([1,1'-Biphenyl]-4-amine, 2-fluoro-3'-(trifluoromethyl)-)

[1,1'-Biphenyl]-4-amine, 2-fluoro-3'-(trifluoromethyl)- structure
819052-91-0 structure
Product Name:[1,1'-Biphenyl]-4-amine, 2-fluoro-3'-(trifluoromethyl)-
CAS No:819052-91-0
MF:C13H9F4N
MW:255.210877180099
CID:1805873
PubChem ID:22142143
Update Time:2025-04-21

[1,1'-Biphenyl]-4-amine, 2-fluoro-3'-(trifluoromethyl)- Chemical and Physical Properties

Names and Identifiers

    • [1,1'-Biphenyl]-4-amine, 2-fluoro-3'-(trifluoromethyl)-
    • 2-fluoro-3'-(trifluoromethyl)-1,1'-biphenyl-4-amine
    • AKOS014773815
    • SCHEMBL2573330
    • A1-39933
    • 4-Amino-2-fluoro-3'-(trifluoromethyl)biphenyl
    • 819052-91-0
    • 3-fluoro-4-[3-(trifluoromethyl)phenyl]aniline
    • 2-Fluoro-3'-(trifluoromethyl)-[1,1'-biphenyl]-4-amine
    • Inchi: 1S/C13H9F4N/c14-12-7-10(18)4-5-11(12)8-2-1-3-9(6-8)13(15,16)17/h1-7H,18H2
    • InChI Key: ZTEHAXKGGDXHNI-UHFFFAOYSA-N
    • SMILES: FC1C=C(C=CC=1C1C=CC=C(C(F)(F)F)C=1)N

Computed Properties

  • Exact Mass: 255.06711194g/mol
  • Monoisotopic Mass: 255.06711194g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 1
  • Complexity: 279
  • 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: 3.9
  • Topological Polar Surface Area: 26?2
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