Cas no 1286777-08-9 (6-Cyano-1H-indole-2-boronic acid)

6-Cyano-1H-indole-2-boronic acid is a versatile boronic acid derivative widely used in Suzuki-Miyaura cross-coupling reactions, a key method for forming carbon-carbon bonds in organic synthesis. The presence of both the cyano and boronic acid functional groups on the indole scaffold enhances its reactivity and utility in constructing complex heterocyclic compounds. This compound is particularly valuable in pharmaceutical and materials science research due to its stability and compatibility with diverse reaction conditions. Its high purity and well-defined structure make it a reliable building block for synthesizing indole-based intermediates, facilitating the development of bioactive molecules and functional materials.
6-Cyano-1H-indole-2-boronic acid structure
1286777-08-9 structure
Product Name:6-Cyano-1H-indole-2-boronic acid
CAS No:1286777-08-9
MF:C9H7BN2O2
MW:185.975081682205
MDL:MFCD28369563
CID:3043058
Update Time:2025-06-06

6-Cyano-1H-indole-2-boronic acid Chemical and Physical Properties

Names and Identifiers

    • 6-Cyano-1H-indole-2-boronic acid
    • (6-cyano-1H-indol-2-yl)boronic acid
    • Boronic acid, B-(6-cyano-1H-indol-2-yl)-
    • SB32649
    • N12657
    • MDL: MFCD28369563
    • Inchi: 1S/C9H7BN2O2/c11-5-6-1-2-7-4-9(10(13)14)12-8(7)3-6/h1-4,12-14H
    • InChI Key: NGZRRRRKSFYROR-UHFFFAOYSA-N
    • SMILES: OB(C1=CC2C=CC(C#N)=CC=2N1)O

Computed Properties

  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 263
  • Topological Polar Surface Area: 80

6-Cyano-1H-indole-2-boronic acid Pricemore >>

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