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Home > Imidazoles > 1856100-92-9
1856100-92-9 | 1-ethyl-5-methyl-4-nitro-1H-imidazole
CAS No: 1856100-92-9 Catalog No: AG01EIMG MDL No:MFCD29911706
Product Description
Catalog Number:
AG01EIMG
Chemical Name:
1-ethyl-5-methyl-4-nitro-1H-imidazole
CAS Number:
1856100-92-9
Molecular Formula:
C6H9N3O2
Molecular Weight:
155.1546
MDL Number:
MFCD29911706
IUPAC Name:
1-ethyl-5-methyl-4-nitroimidazole
InChI:
InChI=1S/C6H9N3O2/c1-3-8-4-7-6(5(8)2)9(10)11/h4H,3H2,1-2H3
InChI Key:
RJJLBLHCXOJGGP-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ncn(c1C)CC
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.069g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
155.157g/mol
Monoisotopic Mass:
155.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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