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Home > Imidazoles > 3034-41-1
3034-41-1 | 1H-Imidazole, 1-methyl-4-nitro-
CAS No: 3034-41-1 Catalog No: AG002ZTF MDL No:MFCD00159683
Product Description
Catalog Number:
AG002ZTF
Chemical Name:
1H-Imidazole, 1-methyl-4-nitro-
CAS Number:
3034-41-1
Molecular Formula:
C4H5N3O2
Molecular Weight:
127.1014
MDL Number:
MFCD00159683
IUPAC Name:
1-methyl-4-nitroimidazole
InChI:
InChI=1S/C4H5N3O2/c1-6-2-4(5-3-6)7(8)9/h2-3H,1H3
InChI Key:
HSCOLDQJZRZQMV-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cn(cn1)C
UNII:
Z31100A55O
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:
-0.4
Literature
| Title | Journal |
|---|---|
| Synthesis and in-vitro antibacterial activity of 5-substituted 1-methyl-4-nitro-1H-imidazoles. | Archiv der Pharmazie 20080801 |
| Synthesis and antihypertensive activities of new 1,4-dihydropyridine containing nitroimidazolyl substituent with a nitrooxy group at the 3-ester position. | Archiv der Pharmazie 20020301 |
| Synthesis and calcium channel antagonist activity of 1,4-dihydropyridine derivatives containing 4-nitroimidazolyl substituents. | Arzneimittel-Forschung 20020101 |
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