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Home Nitros 1-Methyl-5-nitroimidazole

1-Methyl-5-nitroimidazole

CAS No.:
3034-42-2
Catalog Number:
AG002ZTE
Molecular Formula:
C4H5N3O2
Molecular Weight:
127.1014
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$13
- +
5g
97%
In Stock USA
United States
$19
- +
25g
97%
In Stock USA
United States
$62
- +
100g
97%
In Stock USA
United States
$150
- +
500g
97%
In Stock USA
United States
$594
- +
Product Description
Catalog Number:
AG002ZTE
Chemical Name:
1-Methyl-5-nitroimidazole
CAS Number:
3034-42-2
Molecular Formula:
C4H5N3O2
Molecular Weight:
127.1014
MDL Number:
MFCD00126968
IUPAC Name:
1-methyl-5-nitroimidazole
InChI:
InChI=1S/C4H5N3O2/c1-6-3-5-2-4(6)7(8)9/h2-3H,1H3
InChI Key:
JLZXSFPSJJMRIX-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cncn1C
EC Number:
221-225-2
UNII:
LR2H69GV4P
Properties
Complexity:
122  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.038g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
127.103g/mol
Monoisotopic Mass:
127.038g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Literature
Title Journal
Experimental and theoretical studies of the decomposition of new imidazole based energetic materials: model systems. The Journal of chemical physics 20120921
1-Methyl-5-nitro-1H-imidazole. Acta crystallographica. Section E, Structure reports online 20111101
Synthetic routes to mixed-ligand cobalt(III) dithiocarbamato complexes containing imidazole, amine and pyridine donors and the X-ray crystal structure of a cobalt(III) bis(dithiocarbamato) histamine complex. Journal of inorganic biochemistry 20080401
Synthesis, study of 3D structures, and pharmacological activities of lipophilic nitroimidazolyl-1,4-dihydropyridines as calcium channel antagonist. Bioorganic & medicinal chemistry 20060715
Synthesis and evaluation of pharmacological activities of 3, 5-dialkyl 1, 4-dihydro-2,6-dimethyl-4-nitroimidazole-3, 5-pyridine dicarboxylates. Archiv der Pharmazie 20030901
Properties