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Home > Other Heterocycles > 83369-56-6
83369-56-6 | 2-Azabicyclo[2.2.1]hept-5-en-3-one, oxime
CAS No: 83369-56-6 Catalog No: AG004W5E MDL No:
Product Description
Catalog Number:
AG004W5E
Chemical Name:
2-Azabicyclo[2.2.1]hept-5-en-3-one, oxime
CAS Number:
83369-56-6
Molecular Formula:
C6H8N2O
Molecular Weight:
124.1405
IUPAC Name:
N-(2-azabicyclo[2.2.1]hepta-2,5-dien-3-yl)hydroxylamine
InChI:
InChI=1S/C6H8N2O/c9-8-6-4-1-2-5(3-4)7-6/h1-2,4-5,9H,3H2,(H,7,8)
InChI Key:
KTQMFESXFUVGJY-UHFFFAOYSA-N
SMILES:
ON=C1NC2CC1C=C2
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.064g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
124.143g/mol
Monoisotopic Mass:
124.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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