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510122

Sigma-Aldrich

3-(Trifluoromethoxy)phenylboronic acid

≥95%

Synonym(s):

3-Trifluoromethoxybenzeneboronic 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

84-89 °C (lit.)

SMILES string

OB(O)c1cccc(OC(F)(F)F)c1

InChI

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

InChI key

UWDFWVLAHRQSKK-UHFFFAOYSA-N

Application

Precursor commonly used in the synthesis of biologically active compounds including:
  • Multisubstituted purines for use as P2X7 antagonists in the treatment of pain
  • Heteroaryl substituted tetrahydropyrroloijquinolinone derivatives as aldosterone synthase inhibitors
  • Fluorohydroquinolineethanol as a CETP inhibitor
  • Biaryl amides with muscarinic acetylcholine receptor subtype M1 agonist activity
  • C2-aryl pyrrolobenzodiasepine antitumor agents
  • Piperazine-bisamide for obesity treatments

Other Notes

Contains varying amounts of anhydride

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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