Cas no 1181457-88-4 (2-chloro-1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone;hydrochloride)

2-Chloro-1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone hydrochloride is a versatile heterocyclic building block used in pharmaceutical and organic synthesis. Its pyrrolopyridine core structure is valuable for designing bioactive molecules, particularly in medicinal chemistry applications. The chloroacetyl moiety enhances reactivity, enabling efficient derivatization for further functionalization. The hydrochloride salt form improves stability and solubility, facilitating handling and storage. This compound is particularly useful in the development of kinase inhibitors and other small-molecule therapeutics due to its ability to serve as a key intermediate. Its well-defined structure and high purity make it suitable for research and industrial-scale applications requiring precise molecular frameworks.
2-chloro-1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone;hydrochloride structure
1181457-88-4 structure
Product Name:2-chloro-1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone;hydrochloride
CAS No:1181457-88-4
MF:C9H8Cl2N2O
MW:231.07861995697
MDL:MFCD12197050
CID:1036326
PubChem ID:45791459
Update Time:2025-05-28

2-chloro-1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone;hydrochloride Chemical and Physical Properties

Names and Identifiers

    • 2-Chloro-1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone hydrochloride
    • 2-chloro-1-{1H-pyrrolo[2,3-b]pyridin-3-yl}ethan-1-one hydrochloride
    • AC1Q3BFH
    • AG-B-90214
    • AK128680
    • CTK6H4595
    • KB-229292
    • MolPort-016-633-903
    • 2-chloro-1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone;hydrochloride
    • CS-0100105
    • Z2378833037
    • 1181457-88-4
    • DTXSID90672553
    • AKOS016000725
    • 2-Chloro-1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethan-1-one hydrochloride
    • D72270
    • 2-Chloro-1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethanonehydrochloride
    • CS-16540
    • 2-Chloro-1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethan-1-one--hydrogen chloride (1/1)
    • EN300-43974
    • MDL: MFCD12197050
    • Inchi: 1S/C9H7ClN2O.ClH/c10-4-8(13)7-5-12-9-6(7)2-1-3-11-9;/h1-3,5H,4H2,(H,11,12);1H
    • InChI Key: MCTOLNGQPWOFSF-UHFFFAOYSA-N
    • SMILES: ClCC(C1=CNC2C1=CC=CN=2)=O.Cl

Computed Properties

  • Exact Mass: 230.001
  • Monoisotopic Mass: 230.001
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 210
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 45.8A^2

2-chloro-1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone;hydrochloride Pricemore >>

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