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About This Item
Empirical Formula (Hill Notation):
C3H3N3O2
CAS Number:
Molecular Weight:
113.07
UNSPSC Code:
12352005
NACRES:
NA.22
PubChem Substance ID:
EC Number:
208-425-5
Beilstein/REAXYS Number:
116444
MDL number:
Assay:
98%
Form:
solid
InChI key
YZEUHQHUFTYLPH-UHFFFAOYSA-N
InChI
1S/C3H3N3O2/c7-6(8)3-4-1-2-5-3/h1-2H,(H,4,5)
SMILES string
[O-][N+](=O)c1ncc[nH]1
assay
98%
form
solid
mp
287 °C (dec.) (lit.)
functional group
nitro
Quality Level
Related Categories
General description
2-Nitroimidazole is a natural antibiotic.
Application
2-Nitroimidazole was used in the synthesis of:
- tert-butyl 2-(2-nitro-1H-imidazol-1-yl)ethylcarbamate
- 1-(2-(tert-butyldimethylsilyloxy)ethyl)-2-nitro-1H-imidazole
- 2-fluoro-N-(2-(2-nitro-1H-imidazol-1-yl)ethyl)acetamide
- 2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl 2-fluoroacetate
- radiolabeling precursors - the bromo substituted analogs
- nitroimidazole substituted boronic acids, precursors for imaging hypoxic tissue
- potential site-selective radiosensitizers for estrogen receptor-rich tumors
Packaging
Bottomless glass bottle. Contents are inside inserted fused cone.
Analysis Note
solubility :
50 mg/mL in NH4OH : soluble, clear, green-yellow, to very dark green-yellow to very dark yellow
50 mg/mL in NH4OH : soluble, clear, green-yellow, to very dark green-yellow to very dark yellow
signalword
Warning
hcodes
pcodes
Hazard Classifications
Acute Tox. 4 Oral
Storage Class
6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Faceshields, Gloves
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Bryce E Kidd et al.
The journal of physical chemistry. C, Nanomaterials and interfaces, 122(29), 16848-16852 (2018-12-19)
We report a simple and effective method to remove IrIMes homogeneous polarization transfer catalysts from solutions where NMR Signal Amplification By Reversible Exchange (SABRE) has been performed, while leaving intact the substrate's hyperpolarized state. Following microTesla SABRE hyperpolarization of 15N
Christin Glowa et al.
Radiation oncology (London, England), 12(1), 174-174 (2017-11-11)
To summarize the research activities of the "clinical research group heavy ion therapy", funded by the German Research Foundation (DFG, KFO 214), on the impact of intrinsic tumor characteristics (grading, hypoxia) on local tumor control after carbon ( Three sublines
Alane Beatriz Vermelho et al.
Journal of enzyme inhibition and medicinal chemistry, 33(1), 139-146 (2017-12-02)
Sulfonamide carbonic anhydrase (CA, EC 4.2.1.1) inhibitors targeting the α-class enzyme from the protozoan pathogen Trypanosoma cruzi, responsible of Chagas disease, were recently reported. Although many such derivatives showed low nanomolar activity in vitro, they were inefficient anti-T. cruzi agents
J. Chem. Res. Synop., 92-92 (1993)
Yi Qu et al.
Environmental microbiology, 13(4), 1010-1017 (2011-01-20)
Antibiotic resistance in pathogens can be mediated by catabolic enzymes thought to originate from soil bacteria, but the physiological functions and evolutionary origins of the enzymes in natural ecosystems are poorly understood. 2-Nitroimidazole (2NI) is a natural antibiotic and an
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