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566012

3-Acetamidophenylboronic acid

≥95%

Synonym(s):

3-Acetamidobenzeneboronic acid

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About This Item

Linear Formula:
CH3CONHC6H4B(OH)2
CAS Number:
78887-39-5
Molecular Weight:
178.98
UNSPSC Code:
12352103
NACRES:
NA.22
PubChem Substance ID:
24880272
MDL number:
MFCD00236013
Beilstein/REAXYS Number:
3278316
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Quality Segment

100

assay

≥95%

form

powder

mp

135 °C (lit.)

functional group

amide

SMILES string

CC(=O)Nc1cccc(c1)B(O)O

InChI

1S/C8H10BNO3/c1-6(11)10-8-4-2-3-7(5-8)9(12)13/h2-5,12-13H,1H3,(H,10,11)

InChI key

IBTSWKLSEOGJGJ-UHFFFAOYSA-N

Application

Reactant involved in:
  • Suzuki-Miyaura coupling reactions
  • Trifluoromethylation

Reactant involved in the synthesis of a variety of inhibitors including:
  • NR2B subtype of NMDA receptor antagonists for antidepressant activity
  • Biphenylylmethylimidazole derivatives for use as 17,20-lyase inhibitors
  • (Indolyl)-3,5-substituted benzene analogs with antimitotic and antitumor activity
  • Substituted pyrrolidines and tetrahydrofurans as AMPA receptor positive modulators

Other Notes

Contains varying amounts of anhydride.

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)

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