Cas no 115777-53-2 (9H-Carbazole, 3-iodo-9-methyl-)

9H-Carbazole, 3-iodo-9-methyl- structure
115777-53-2 structure
Product Name:9H-Carbazole, 3-iodo-9-methyl-
CAS No:115777-53-2
MF:C13H10IN
MW:307.129675388336
CID:1205041
PubChem ID:4300196
Update Time:2025-04-20

9H-Carbazole, 3-iodo-9-methyl- Chemical and Physical Properties

Names and Identifiers

    • 9H-Carbazole, 3-iodo-9-methyl-
    • 3-iodo-9-methylcarbazole
    • SCHEMBL1922079
    • 115777-53-2
    • DTXSID40401698
    • 3-iodo-9-methyl-9H-carbazole
    • AKOS001679498
    • STK831914
    • EU-0011887
    • Inchi: 1S/C13H10IN/c1-15-12-5-3-2-4-10(12)11-8-9(14)6-7-13(11)15/h2-8H,1H3
    • InChI Key: UMCVEEUYGKMYLI-UHFFFAOYSA-N
    • SMILES: IC1C=CC2=C(C=1)C1C=CC=CC=1N2C

Computed Properties

  • Exact Mass: 306.9854
  • Monoisotopic Mass: 306.98580g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 15
  • 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
  • XLogP3: 4
  • Topological Polar Surface Area: 4.9?2

Experimental Properties

  • PSA: 4.93
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