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Home > Imidazoles > 19183-17-6
19183-17-6 | 1,2-dimethyl-4,5-dinitro-1H-imidazole
CAS No: 19183-17-6 Catalog No: AG01AOCB MDL No:MFCD09701715
Product Description
Catalog Number:
AG01AOCB
Chemical Name:
1,2-dimethyl-4,5-dinitro-1H-imidazole
CAS Number:
19183-17-6
Molecular Formula:
C5H6N4O4
Molecular Weight:
186.1255
MDL Number:
MFCD09701715
IUPAC Name:
1,2-dimethyl-4,5-dinitroimidazole
InChI:
InChI=1S/C5H6N4O4/c1-3-6-4(8(10)11)5(7(3)2)9(12)13/h1-2H3
InChI Key:
AQLUEEMSUSDYEU-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(nc(n1C)C)[N+](=O)[O-]
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.039g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.127g/mol
Monoisotopic Mass:
186.039g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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