Nombre: isoquinoline N-oxide
SMILES:
[O-][n+]1ccc2ccccc2c1Molecular Processing
Molecular formula
C9H7NO
Molecular weight
145.16
Exact mass
145.0528
XLogP
1.47
TPSA
26.94
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
11
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0
Molar refractivity
42.91
Supplementary Information
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