structure of 1-(Tetrahydropyran-2-ylmethyl)-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-1h-pyrazole

1-(Tetrahydropyran-2-ylmethyl)-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-1h-pyrazole

CAS No.: 1000802-49-2
M. Wt: 292.18
M. Fa: C15H25BN2O3
InChI Key: MVRXQASPIAXVOC-UHFFFAOYSA-N

Names and Identifiers of 1000802-49-2

CAS Number

1000802-49-2

IUPAC Name

1-(oxan-2-ylmethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole

InChI

InChI=1S/C15H25BN2O3/c1-14(2)15(3,4)21-16(20-14)12-9-17-18(10-12)11-13-7-5-6-8-19-13/h9-10,13H,5-8,11H2,1-4H3

InChIKey

MVRXQASPIAXVOC-UHFFFAOYSA-N

Canonical SMILES

B1(OC(C(O1)(C)C)(C)C)C2=CN(N=C2)CC3CCCCO3

Physical and chemical properties of 1000802-49-2

Molecular Formula

C15H25BN2O3

Molecular Weight

292.18

Safety Information of 1000802-49-2

Pictograms

Signal Word

 Warning

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

Applications of 1000802-49-2

The compound has potential applications in:

  • Medicinal Chemistry: As a building block for synthesizing pharmaceuticals due to its unique structure and reactivity.
  • Organic Synthesis: In synthetic methodologies that require boron-containing reagents for forming carbon-carbon bonds.
  • Material Science: Potential use in developing new materials or polymers that incorporate pyrazole or boron functionalities.

Interaction Studies of 1000802-49-2

Interaction studies involving this compound are essential to understand its behavior in biological systems. Preliminary assessments could focus on:

  • Reactivity with biological nucleophiles: Investigating how the compound interacts with biomolecules such as proteins and nucleic acids.
  • In vitro assays: Evaluating its potential pharmacological effects on various cell lines to assess toxicity and efficacy.