Cas no 90016-93-6 (1-Iodonaphthalen-2-amine)

1-Iodonaphthalen-2-amine is a halogenated naphthylamine derivative characterized by the presence of an iodine substituent at the 1-position and an amino group at the 2-position of the naphthalene ring. This compound serves as a versatile intermediate in organic synthesis, particularly in cross-coupling reactions such as the Buchwald-Hartwig amination or Suzuki-Miyaura coupling, owing to the reactivity of the iodine moiety. The amino group further enhances its utility by enabling functionalization or coordination in metal-catalyzed transformations. Its well-defined structure and stability under controlled conditions make it suitable for applications in pharmaceuticals, agrochemicals, and materials science. Proper handling under inert atmospheres is recommended due to potential sensitivity to light and moisture.
1-Iodonaphthalen-2-amine structure
1-Iodonaphthalen-2-amine structure
Product Name:1-Iodonaphthalen-2-amine
CAS No:90016-93-6
MF:C10H8IN
MW:269.081694602966
MDL:MFCD10698813
CID:871171
PubChem ID:13131238
Update Time:2025-05-28

1-Iodonaphthalen-2-amine Chemical and Physical Properties

Names and Identifiers

    • 2-Naphthalenamine, 1-iodo-
    • 1-iodonaphthalen-2-amine
    • 2-AMINO-1-IODONAPHTHALENE
    • DTXSID60520830
    • CS-0433547
    • SCHEMBL11793408
    • AB92282
    • 90016-93-6
    • DB-226265
    • 1-Iodo-2-naphthalenamine
    • 1-Iodonaphthalen-2-amine
    • MDL: MFCD10698813
    • Inchi: 1S/C10H8IN/c11-10-8-4-2-1-3-7(8)5-6-9(10)12/h1-6H,12H2
    • InChI Key: VFKAZALEEBHHAG-UHFFFAOYSA-N
    • SMILES: IC1C(=CC=C2C=CC=CC2=1)N

Computed Properties

  • Exact Mass: 268.97015g/mol
  • Monoisotopic Mass: 268.97015g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 160
  • 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: 3.1
  • Topological Polar Surface Area: 26?2

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