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Home > Other Heterocycles > 83369-28-2
83369-28-2 | 2-Oxabicyclo[2.2.2]oct-5-en-3-one, oxime
CAS No: 83369-28-2 Catalog No: AG004S5B MDL No:
Product Description
Catalog Number:
AG004S5B
Chemical Name:
2-Oxabicyclo[2.2.2]oct-5-en-3-one, oxime
CAS Number:
83369-28-2
Molecular Formula:
C7H9NO2
Molecular Weight:
139.1519
IUPAC Name:
N-(2-oxabicyclo[2.2.2]oct-5-en-3-ylidene)hydroxylamine
InChI:
InChI=1S/C7H9NO2/c9-8-7-5-1-3-6(10-7)4-2-5/h1,3,5-6,9H,2,4H2
InChI Key:
GKRDTGFOYFCVKN-UHFFFAOYSA-N
SMILES:
ON=C1OC2CCC1C=C2
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.063g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
139.154g/mol
Monoisotopic Mass:
139.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
1
XLogP3:
1.3
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