SMILES:
O=C(OC[n+]1ccccc1)c1ccccc1Molecular Processing
Molecular formula
C13H12NO2+
Molecular weight
214.24
Exact mass
214.0863
XLogP
1.79
TPSA
30.18
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
1
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
58.49
Supplementary Information
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