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123837-16-1 | 1-Azabicyclo[2.2.2]octane-3-carboximidamide, N-hydroxy-
CAS No: 123837-16-1 Catalog No: AG000L5Z MDL No:
Product Description
Catalog Number:
AG000L5Z
Chemical Name:
1-Azabicyclo[2.2.2]octane-3-carboximidamide, N-hydroxy-
CAS Number:
123837-16-1
Molecular Formula:
C8H15N3O
Molecular Weight:
169.2242
IUPAC Name:
N'-hydroxy-1-azabicyclo[2.2.2]octane-3-carboximidamide
InChI:
InChI=1S/C8H15N3O/c9-8(10-12)7-5-11-3-1-6(7)2-4-11/h6-7,12H,1-5H2,(H2,9,10)
InChI Key:
QEFKGCLVACFUSZ-UHFFFAOYSA-N
SMILES:
ONC(=N)C1CN2CCC1CC2
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.122g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
169.228g/mol
Monoisotopic Mass:
169.122g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
-0.1
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