1H-Imidazole, 4-methyl-5-nitro-


Chemical Name: 1H-Imidazole, 4-methyl-5-nitro-
CAS Number: 14003-66-8
Product Number: AG001BYO(AGN-PC-0O1YIB)
Synonyms:
MDL No:
Molecular Formula: C4H5N3O2
Molecular Weight: 127.1014

Identification/Properties


Properties
MP:
249°C(lit.);
BP:
296.4°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.5000 (estimate)
Computed Properties
Molecular Weight:
127.103g/mol
XLogP3:
0.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
127.038g/mol
Monoisotopic Mass:
127.038g/mol
Topological Polar Surface Area:
74.5A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
122
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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