Cas no 496805-58-4 ([1,1'-Biphenyl]-3-amine, 2'-fluoro-2-methyl-)

[1,1'-Biphenyl]-3-amine, 2'-fluoro-2-methyl- structure
496805-58-4 structure
Product Name:[1,1'-Biphenyl]-3-amine, 2'-fluoro-2-methyl-
CAS No:496805-58-4
MF:C13H12FN
MW:201.239486694336
CID:1535768
PubChem ID:103846331
Update Time:2025-04-21

[1,1'-Biphenyl]-3-amine, 2'-fluoro-2-methyl- Chemical and Physical Properties

Names and Identifiers

    • [1,1'-Biphenyl]-3-amine, 2'-fluoro-2-methyl-
    • A1-19155
    • 2'-fluoro-2-methyl-[1,1'-biphenyl]-3-amine
    • 3-(2-Fluorophenyl)-2-methylaniline
    • 496805-58-4
    • Inchi: 1S/C13H12FN/c1-9-10(6-4-8-13(9)15)11-5-2-3-7-12(11)14/h2-8H,15H2,1H3
    • InChI Key: BZOOZDYASDAZTM-UHFFFAOYSA-N
    • SMILES: FC1C=CC=CC=1C1C=CC=C(C=1C)N

Computed Properties

  • Exact Mass: 201.09546
  • Monoisotopic Mass: 201.095377549g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 1
  • Complexity: 207
  • 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: 3.3
  • Topological Polar Surface Area: 26?2

Experimental Properties

  • PSA: 26.02

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