1H-Imidazole, 1-methyl-2-(1-methylethyl)-5-nitro-


Chemical Name: 1H-Imidazole, 1-methyl-2-(1-methylethyl)-5-nitro-
CAS Number: 14885-29-1
Product Number: AG01CBXP(AGN-PC-00UN52)
Synonyms:
MDL No:
Molecular Formula: C7H11N3O2
Molecular Weight: 169.18114

Identification/Properties


Computed Properties
Molecular Weight:
169.184g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
169.085g/mol
Monoisotopic Mass:
169.085g/mol
Topological Polar Surface Area:
63.6A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
178
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

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NMR Spectrum


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