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510130

Sigma-Aldrich

4-(Trifluoromethoxy)phenylboronic acid

≥95%

Synonym(s):

4-(Trifluoromethoxy)benzeneboronic acid

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About This Item

Linear Formula:
CF3OC6H4B(OH)2
CAS Number:
Molecular Weight:
205.93
MDL number:
UNSPSC Code:
12352103
PubChem Substance ID:
NACRES:
NA.22

Assay

≥95%

mp

123-127 °C (lit.)

SMILES string

OB(O)c1ccc(OC(F)(F)F)cc1

InChI

1S/C7H6BF3O3/c9-7(10,11)14-6-3-1-5(2-4-6)8(12)13/h1-4,12-13H

InChI key

HUOFUOCSQCYFPW-UHFFFAOYSA-N

Application

Reactant involved in the synthesis of biologically active molecules including:
  • Lactate dehydrogenase inhibitors for use against cancer cell proliferation
  • Nitro-phenoxybenzoic acid derivatives for PAI-1 inhibition
  • PA-824 analogs for use as antituberculosis drugs
  • Modulators of survival motor neuron protein

Reactant involved in addition reactions and cross-coupling reactions including Suzuki-Miyaura cross-coupling

Other Notes

Contains varying amounts of anhydride

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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