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Home > Imidazoles > 90349-16-9
90349-16-9 | Benzimidazole, 1-ethyl-6-nitro- (7CI)
CAS No: 90349-16-9 Catalog No: AG00H0NW MDL No:
Product Description
Catalog Number:
AG00H0NW
Chemical Name:
Benzimidazole, 1-ethyl-6-nitro- (7CI)
CAS Number:
90349-16-9
IUPAC Name:
1-ethyl-6-nitrobenzimidazole
InChI:
InChI=1S/C9H9N3O2/c1-2-11-6-10-8-4-3-7(12(13)14)5-9(8)11/h3-6H,2H2,1H3
InChI Key:
SPYBNKTYLRKYAD-UHFFFAOYSA-N
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.069g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.19g/mol
Monoisotopic Mass:
191.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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