CAS 153254-09-2 2,4-Bis(trifluoromethyl)phenylboronic Acid (contains varying amounts of Anhydride)

NAVIGATION

2,4-Bis(trifluoromethyl)phenylboronic Acid (contains varying amounts of Anhydride)

PRICE INQUIRY

Catalog Number

ACM153254092-2

CAS Number

153254-09-2

Product Name

2,4-Bis(trifluoromethyl)phenylboronic Acid (contains varying amounts of Anhydride)

Category

Salt

Synonyms

BBL103050; CTK0H4593; QC-4547; AB09366; 254B092; DTXSID20382198; AK-33431; B-3039; 2,4-Bis(trifluoromethyl)benzeneboronic Acid; 2,4-bistrifluoromethylbenzeneboronic acid;

IUPAC Name

[2,4-bis(trifluoromethyl)phenyl]boronic acid;

Molecular Weight

257.926g/mol

Molecular Formula

C8H5BF6O2;

Canonical SMILES

B(C1=C(C=C(C=C1)C(F)(F)F)C(F)(F)F)(O)O;

InChI

InChI=1S/C8H5BF6O2/c10-7(11,12)4-1-2-6(9(16)17)5(3-4)8(13,14)15/h1-3,16-17H;

InChI Key

WLYPBMBWKYALCG-UHFFFAOYSA-N;

Application

2,4-Bis(trifluoromethyl)phenylboronic Acid, which may include varying amounts of anhydride, serves as a vital white crystalline reactant in the synthesis of various compounds with significant applications. It is utilized in the preparation of pyrrolo[2,3-d]pyrimidin-4-ones, known as corticotropin-releasing factor 1 receptor antagonists, featuring a carbonyl-based hydrogen bonding acceptor. Additionally, it is employed in the production of biaryl pyrazole carboxamides for sodium channel blocking, offering potential treatment avenues for neuropathic pain. The compound also aids in the development of biphenylketones, which act as dual modulators of inflammation and bone loss. Furthermore, it plays a role in the synthesis of (biphenylyl)pyrazolecarboxamides and their subsequent evaluation in blocking voltage-gated sodium channel Nav1.7, as well as in the creation of N-hydroxyalkyl biphenylsulfonamides that inhibit bone resorption. Finally, it contributes to the formation of 1,3,6,8a-tetraazaacenaphthylene derivatives studied for corticotropin-releasing factor-1 antagonism, and in the synthesis of blue luminescent iridium phenylpyridine complexes, showcasing its versatility across various research areas.

Complexity

264

Covalently-Bonded Unit Count

EC Number

604-892-8

Exact Mass

258.029g/mol

Heavy Atom Count

Monoisotopic Mass

258.029g/mol

Rotatable Bond Count

Topological Polar Surface Area