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19182-82-2 | 1H-Imidazole, 2-methyl-1,4-dinitro-
CAS No: 19182-82-2 Catalog No: AG0074OB MDL No:
Product Description
Catalog Number:
AG0074OB
Chemical Name:
1H-Imidazole, 2-methyl-1,4-dinitro-
CAS Number:
19182-82-2
Molecular Formula:
C4H4N4O4
Molecular Weight:
172.0990
IUPAC Name:
2-methyl-1,4-dinitroimidazole
InChI:
InChI=1S/C4H4N4O4/c1-3-5-4(7(9)10)2-6(3)8(11)12/h2H,1H3
InChI Key:
BVFZUJRMDAZULW-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cn(c(n1)C)[N+](=O)[O-]
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.023g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.1g/mol
Monoisotopic Mass:
172.023g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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