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Home > Other Heterocycles > 828255-58-9
828255-58-9 | 1-Azabicyclo[2.2.1]heptane, 3-(3-ethyl-1,2,4-oxadiazol-5-yl)-, 1-oxide
CAS No: 828255-58-9 Catalog No: AG00568M MDL No:
Product Description
Catalog Number:
AG00568M
Chemical Name:
1-Azabicyclo[2.2.1]heptane, 3-(3-ethyl-1,2,4-oxadiazol-5-yl)-, 1-oxide
CAS Number:
828255-58-9
Molecular Formula:
C10H15N3O2
Molecular Weight:
209.2450
IUPAC Name:
3-ethyl-5-(1-oxido-1-azoniabicyclo[2.2.1]heptan-3-yl)-1,2,4-oxadiazole
InChI:
InChI=1S/C10H15N3O2/c1-2-9-11-10(15-12-9)8-6-13(14)4-3-7(8)5-13/h7-8H,2-6H2,1H3
InChI Key:
UJEWWKMCIGZBDG-UHFFFAOYSA-N
SMILES:
CCc1noc(n1)C1C[N+]2(CC1CC2)[O-]
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.116g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.249g/mol
Monoisotopic Mass:
209.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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