Cas no 1256354-98-9 ((2,4-Bis(methoxycarbonyl)phenyl)boronic acid)

(2,4-Bis(methoxycarbonyl)phenyl)boronic acid is a boronic acid derivative featuring two methoxycarbonyl substituents on the phenyl ring. This compound is primarily utilized in Suzuki-Miyaura cross-coupling reactions, where its electron-withdrawing ester groups enhance reactivity and selectivity in forming carbon-carbon bonds. The presence of the boronic acid moiety allows for efficient coupling with aryl or vinyl halides, making it valuable in pharmaceutical and materials science applications. Its stability under mild conditions and compatibility with diverse reaction environments further contribute to its utility in synthetic chemistry. The compound is typically handled under inert conditions to preserve its reactivity.
(2,4-Bis(methoxycarbonyl)phenyl)boronic acid structure
1256354-98-9 structure
Product Name:(2,4-Bis(methoxycarbonyl)phenyl)boronic acid
CAS No:1256354-98-9
MF:C10H11BO6
MW:238.001743555069
MDL:MFCD17015764
CID:828152
PubChem ID:53216469
Update Time:2025-06-08

(2,4-Bis(methoxycarbonyl)phenyl)boronic acid Chemical and Physical Properties

Names and Identifiers

    • (2,4-Bis(methoxycarbonyl)phenyl)boronic acid
    • 2,4-Bis(Methoxycarbonyl)phenylboronic acid
    • MFCD17015764
    • AKOS015852165
    • E84448
    • [2,4-bis(methoxycarbonyl)phenyl]boronic acid
    • DB-355183
    • SCHEMBL14829748
    • (2,4-Bis(methoxycarbonyl)phenyl)boronicacid
    • CS-0173970
    • 1,3-Benzenedicarboxylic acid, 4-borono-, 1,3-dimethyl ester
    • 1256354-98-9
    • BS-19803
    • DTXSID30681700
    • MDL: MFCD17015764
    • Inchi: 1S/C10H11BO6/c1-16-9(12)6-3-4-8(11(14)15)7(5-6)10(13)17-2/h3-5,14-15H,1-2H3
    • InChI Key: BUXKKSVFGRKVGD-UHFFFAOYSA-N
    • SMILES: O(C)C(C1C=C(C(=O)OC)C=CC=1B(O)O)=O

Computed Properties

  • Exact Mass: 238.06500
  • Monoisotopic Mass: 238.0648682g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 5
  • Complexity: 293
  • 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: 93.1?2

Experimental Properties

  • PSA: 93.06000
  • LogP: -1.06040

(2,4-Bis(methoxycarbonyl)phenyl)boronic acid Pricemore >>

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