Cas no 1029654-29-2 ((2-Chloro-4-methylpyridin-3-yl)boronic acid)

(2-Chloro-4-methylpyridin-3-yl)boronic acid is a versatile boronic acid derivative commonly employed as a key intermediate in Suzuki-Miyaura cross-coupling reactions. Its pyridine scaffold, substituted with chloro and methyl groups, enhances reactivity and selectivity in forming carbon-carbon bonds, particularly in pharmaceutical and agrochemical synthesis. The boronic acid functionality allows for efficient coupling with aryl or vinyl halides under mild conditions, enabling the construction of complex heterocyclic frameworks. This compound exhibits good stability under standard handling conditions and is compatible with a range of solvents and catalysts. Its structural features make it valuable for synthesizing targeted bioactive molecules, offering precise control in medicinal chemistry and material science applications.
(2-Chloro-4-methylpyridin-3-yl)boronic acid structure
1029654-29-2 structure
Product Name:(2-Chloro-4-methylpyridin-3-yl)boronic acid
CAS No:1029654-29-2
MF:C6H7BClNO2
MW:171.389280557632
MDL:MFCD07437889
CID:1035437
PubChem ID:2763130
Update Time:2025-10-24

(2-Chloro-4-methylpyridin-3-yl)boronic acid Chemical and Physical Properties

Names and Identifiers

    • (2-Chloro-4-methylpyridin-3-yl)boronic acid
    • 2-Chloro-4-methylpyridine-3-boronic acid
    • 2-CHLORO-4-PICOLINE-3-BORONIC ACID
    • 2-chloro-4-methylpyridin-3-ylboronic acid
    • DB-082554
    • AKOS006284368
    • MFCD07437889
    • SCHEMBL15573110
    • 2-chloro-4-picoline-3-boronicacid
    • CS-0189139
    • 1029654-29-2
    • DTXSID20376754
    • AB41946
    • FD10152
    • 2-Chloro-4-methylpyridine-3-boronicacid
    • MDL: MFCD07437889
    • Inchi: 1S/C6H7BClNO2/c1-4-2-3-9-6(8)5(4)7(10)11/h2-3,10-11H,1H3
    • InChI Key: VCGWAHJXFWBCSW-UHFFFAOYSA-N
    • SMILES: ClC1C(B(O)O)=C(C)C=CN=1

Computed Properties

  • Exact Mass: 171.02600
  • Monoisotopic Mass: 171.0258363g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 136
  • 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: 53.4?2

Experimental Properties

  • PSA: 53.35000
  • LogP: -0.27680

(2-Chloro-4-methylpyridin-3-yl)boronic acid Pricemore >>

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