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309877

Sigma-Aldrich

4-Bromo-2-nitrophenol

98%

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About This Item

Linear Formula:
BrC6H3(NO2)OH
CAS Number:
7693-52-9
Molecular Weight:
218.00
EC Number:
231-707-4
MDL number:
MFCD00082540
UNSPSC Code:
12352100
PubChem Substance ID:
24858754
NACRES:
NA.22

assay

98%

mp

90-94 °C (lit.)

SMILES string

Oc1ccc(Br)cc1[N+]([O-])=O

InChI

1S/C6H4BrNO3/c7-4-1-2-6(9)5(3-4)8(10)11/h1-3,9H

InChI key

CUTFAPGINUFNQM-UHFFFAOYSA-N

General description

The Suzuki coupling of 4-bromo-2-nitrophenol with boronic acid was studied.

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Faceshields, Gloves

Certificates of Analysis (COA)

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Adwoa Akwabi-Ameyaw et al.
Bioorganic & medicinal chemistry letters, 19(16), 4733-4739 (2009-07-10)
Two series of conformationally constrained analogs of the FXR agonist GW 4064 1 were prepared. Replacement of the metabolically labile stilbene with either benzothiophene or naphthalene rings led to the identification of potent full agonists 2a and 2g.

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