Cas no 648933-96-4 (Naphthalene, 2-(1,1-dimethylethyl)-7-iodo-)

Naphthalene, 2-(1,1-dimethylethyl)-7-iodo- structure
648933-96-4 structure
Product Name:Naphthalene, 2-(1,1-dimethylethyl)-7-iodo-
CAS No:648933-96-4
MF:C14H15I
MW:310.173376321793
CID:411847
PubChem ID:71377964
Update Time:2025-04-19

Naphthalene, 2-(1,1-dimethylethyl)-7-iodo- Chemical and Physical Properties

Names and Identifiers

    • Naphthalene, 2-(1,1-dimethylethyl)-7-iodo-
    • 2-tert-butyl-7-iodonaphthalene
    • 2-(tert-Butyl)-7-iodonaphthalene
    • DTXSID20800589
    • 648933-96-4
    • Inchi: 1S/C14H15I/c1-14(2,3)12-6-4-10-5-7-13(15)9-11(10)8-12/h4-9H,1-3H3
    • InChI Key: GRWIIVMYPRPMQV-UHFFFAOYSA-N
    • SMILES: IC1C=CC2C=CC(=CC=2C=1)C(C)(C)C

Computed Properties

  • Exact Mass: 310.02145
  • Monoisotopic Mass: 310.02185g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 1
  • Complexity: 216
  • 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: 5.9
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • PSA: 0
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