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Home > Imidazoles > 123845-90-9
123845-90-9 | 1H-Imidazole, 1,2-dimethyl-4-(1,1,2-trimethyl-2-nitropropyl)-
CAS No: 123845-90-9 Catalog No: AG000L5M MDL No:
Product Description
Catalog Number:
AG000L5M
Chemical Name:
1H-Imidazole, 1,2-dimethyl-4-(1,1,2-trimethyl-2-nitropropyl)-
CAS Number:
123845-90-9
Molecular Formula:
C11H19N3O2
Molecular Weight:
225.2875
IUPAC Name:
4-(2,3-dimethyl-3-nitrobutan-2-yl)-1,2-dimethylimidazole
InChI:
InChI=1S/C11H19N3O2/c1-8-12-9(7-13(8)6)10(2,3)11(4,5)14(15)16/h7H,1-6H3
InChI Key:
GCUOYVDUXOANNC-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)C(C(c1cn(c(n1)C)C)(C)C)(C)C
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.148g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.292g/mol
Monoisotopic Mass:
225.148g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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