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18888-57-8 | 1H-Imidazole, 1,2,4-trimethyl-5-nitro-
CAS No: 18888-57-8 Catalog No: AG002HGH MDL No:
Product Description
Catalog Number:
AG002HGH
Chemical Name:
1H-Imidazole, 1,2,4-trimethyl-5-nitro-
CAS Number:
18888-57-8
Molecular Formula:
C6H9N3O2
Molecular Weight:
155.1546
IUPAC Name:
1,2,4-trimethyl-5-nitroimidazole
InChI:
InChI=1S/C6H9N3O2/c1-4-6(9(10)11)8(3)5(2)7-4/h1-3H3
InChI Key:
SKURQPNZMVXVBW-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(C)nc(n1C)C
Properties
Complexity:
168
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:
0
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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