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Key Documents

471917

Sigma-Aldrich

3,4-Dichlorophenylboronic acid

≥95%

Synonym(s):

3,4-Dichlorobenzeneboronic acid

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About This Item

Linear Formula:
Cl2C6H3B(OH)2
CAS Number:
Molecular Weight:
190.82
MDL number:
UNSPSC Code:
12352103
PubChem Substance ID:
NACRES:
NA.22

Assay

≥95%

form

powder

mp

280-285 °C (lit.)

SMILES string

OB(O)c1ccc(Cl)c(Cl)c1

InChI

1S/C6H5BCl2O2/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,10-11H

InChI key

JKIGHOARKAIPJI-UHFFFAOYSA-N

Application

Reactant involved in:
  • Lithiation/borylation-protodeboronation of homoallyl carbamates
  • Suzuki coupling reactions

Precursor / reactant involved in synthesis of biologically active molecules including:
  • Mycobacterium tuberculosis H37Rv chorismate mutase inhibitors
  • Pyrrole derivatives as PDE4B inhibitors
  • Nitrovinyl biphenyls as anticancer agents
  • Dual immunosuppressive and anti-inflammatory agents
  • Pyrazolopyrimidines as Cryptosporidium and Toxoplasma CDPK1 inhibitors

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

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)

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