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About This Item
Linear Formula:
BrC6H3(NO2)OH
CAS Number:
Molecular Weight:
218.00
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
231-707-4
MDL number:
Assay:
98%
Quality Level
assay
98%
mp
90-94 °C (lit.)
functional group
bromo, nitro
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.
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
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Faceshields, Gloves
Regulatory Information
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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.
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 309877-25G | 04061826676493 |
| 309877-5G | 04061832279794 |
