Cas no 68218-30-4 (1H-Isoindole-1,3(2H)-dione, 5,6-diiodo-)

1H-Isoindole-1,3(2H)-dione, 5,6-diiodo- structure
68218-30-4 structure
Product Name:1H-Isoindole-1,3(2H)-dione, 5,6-diiodo-
CAS No:68218-30-4
MF:C8H3I2NO2
MW:398.923866510391
CID:4142301
PubChem ID:10739678
Update Time:2025-04-24

1H-Isoindole-1,3(2H)-dione, 5,6-diiodo- Chemical and Physical Properties

Names and Identifiers

    • 1H-Isoindole-1,3(2H)-dione, 5,6-diiodo-
    • 4,5-diiodophthalimide
    • 68218-30-4
    • Inchi： 1S/C8H3I2NO2/c9-5-1-3-4(2-6(5)10)8(13)11-7(3)12/h1-2H,(H,11,12,13)
    • InChI Key： HCZXEHIZHZGQEB-UHFFFAOYSA-N
    • SMILES： C1(=O)C2=C(C=C(I)C(I)=C2)C(=O)N1

Computed Properties

  • Exact Mass: 398.82532 g/mol
  • Monoisotopic Mass: 398.82532 g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 0
  • Complexity: 243
  • 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
  • Molecular Weight: 398.92
  • XLogP3: 2
  • Topological Polar Surface Area: 46.2?2

1H-Isoindole-1,3(2H)-dione, 5,6-diiodo- Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Iodine ,  Fuming sulfuric acid ;  40 h, 80 - 85 °C
Reference
Design, Synthesis, and Properties of New Derivatives of Pentacene
Jiang, Jinyue; et al, Journal of Organic Chemistry, 2006, 71(5), 2155-2158

1H-Isoindole-1,3(2H)-dione, 5,6-diiodo- Preparation Products

1H-Isoindole-1,3(2H)-dione, 5,6-diiodo- Related Literature

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