Cas no 1234616-00-2 (3-bromo-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid)

3-bromo-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid structure
1234616-00-2 structure
Product Name:3-bromo-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid
CAS No:1234616-00-2
MF:C8H5BrN2O2
MW:241.041500806808
MDL:MFCD17214371
CID:2618486
PubChem ID:72207433
Update Time:2025-09-25

3-bromo-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 3-bromo-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid
    • PB22898
    • MFCD17214371
    • CS-0055193
    • PS-15350
    • DB-424614
    • 1234616-00-2
    • SCHEMBL22554109
    • 3-BROMO-1H-PYRROLO[2,3-B]PYRIDINE-5-CARBOXYLICACID
    • P12152
    • SY259702
    • 851-920-1
    • 3-Bromo-1H-pyrrolo(2,3-b)pyridine-5-carboxylic acid
    • MDL: MFCD17214371
    • Inchi: 1S/C8H5BrN2O2/c9-6-3-11-7-5(6)1-4(2-10-7)8(12)13/h1-3H,(H,10,11)(H,12,13)
    • InChI Key: LKXGBGGSAMCDSJ-UHFFFAOYSA-N
    • SMILES: BrC1=CNC2C1=CC(C(=O)O)=CN=2

Computed Properties

  • Exact Mass: 239.95344g/mol
  • Monoisotopic Mass: 239.95344g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 224
  • 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: 1.5
  • Topological Polar Surface Area: 66?2

3-bromo-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid Pricemore >>

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