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Home > Imidazoles > 77972-40-8
77972-40-8 | 1-[2-(2-Nitro-1H-imidazol-1-yl)ethyl]piperidine 1-oxide
CAS No: 77972-40-8 Catalog No: AG00GGVU MDL No:
Product Description
Catalog Number:
AG00GGVU
Chemical Name:
1-[2-(2-Nitro-1H-imidazol-1-yl)ethyl]piperidine 1-oxide
CAS Number:
77972-40-8
IUPAC Name:
1-[2-(2-nitroimidazol-1-yl)ethyl]-1-oxidopiperidin-1-ium
InChI:
InChI=1S/C10H16N4O3/c15-13(16)10-11-4-5-12(10)6-9-14(17)7-2-1-3-8-14/h4-5H,1-3,6-9H2
InChI Key:
WYHTVOYFMAFXFN-UHFFFAOYSA-N
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.122g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.263g/mol
Monoisotopic Mass:
240.122g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
81.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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