Cas no 18799-87-6 (3-Iodo-2,5-thiophenedicarbaldehyde)

3-Iodo-2,5-thiophenedicarbaldehyde structure
18799-87-6 structure
Product Name:3-Iodo-2,5-thiophenedicarbaldehyde
CAS No:18799-87-6
MF:C6H3IO2S
MW:266.056292772293
CID:2659463
Update Time:2023-08-06

3-Iodo-2,5-thiophenedicarbaldehyde Chemical and Physical Properties

Names and Identifiers

    • 3-Iodo-2,5-thiophenedicarbaldehyde
    • Inchi: 1S/C6H3IO2S/c7-5-1-4(2-8)10-6(5)3-9/h1-3H
    • InChI Key: XQMYJNGEGBKWSG-UHFFFAOYSA-N
    • SMILES: IC1C=C(C=O)SC=1C=O

Computed Properties

  • Exact Mass: 265.89
  • Monoisotopic Mass: 265.89
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 2
  • Complexity: 151
  • 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
  • Topological Polar Surface Area: 62.4
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