structure of 4-(Methoxymethoxy)-2,6-dimethylphenylboronic acid

4-(Methoxymethoxy)-2,6-dimethylphenylboronic acid

CAS No.: 1000414-17-4
M. Wt: 210.03500
M. Fa: C10H15BO4
InChI Key: KAAMSKWLTRGLFW-UHFFFAOYSA-N

Names and Identifiers of 1000414-17-4

CAS Number

1000414-17-4

MDL Number

MFCD20526372

IUPAC Name

[4-(methoxymethoxy)-2,6-dimethylphenyl]boronic acid

InChI

InChI=1S/C10H15BO4/c1-7-4-9(15-6-14-3)5-8(2)10(7)11(12)13/h4-5,12-13H,6H2,1-3H3

InChIKey

KAAMSKWLTRGLFW-UHFFFAOYSA-N

Canonical SMILES

B(C1=C(C=C(C=C1C)OCOC)C)(O)O

UNSPSC Code

12352100

Physical and chemical properties of 1000414-17-4

Acidity coefficient

8.77±0.58(Predicted)

Boiling Point

383.5±52.0 °C(Predicted)

Density

1.14±0.1 g/cm3(Predicted)

Exact Mass

210.10600

H Bond Acceptors

4

H Bond Donors

2

LogP

2.5242

Molecular Formula

C10H15BO4

Molecular Weight

210.03500

PSA

58.92000

Safety Information of 1000414-17-4

Pictograms

Signal Word

 Warning

Safety Data Sheet
Supports customized editing of SDS information and downloading in PDF documents.

Applications of 1000414-17-4

4-(Methoxymethoxy)-2,6-dimethylphenylboronic acid has significant applications in organic synthesis, particularly in:

  • Suzuki-Miyaura Couplings: It serves as a coupling partner in the formation of complex organic molecules.
  • Pharmaceutical Development: Its ability to form stable bonds with various organic substrates makes it valuable in drug discovery and development processes.

Biological Activity of 1000414-17-4

While specific biological activities of 4-(Methoxymethoxy)-2,6-dimethylphenylboronic acid have not been extensively documented in available literature, boronic acids in general have been studied for their potential in medicinal chemistry. These compounds can interact with biological systems through reversible binding to diols and other biomolecules, suggesting a role in drug development and therapeutic applications.