SMILES:
Nc1ccc(I)cc1C=OMolecular Processing
Molecular formula
C7H6INO
Molecular weight
247.04
Exact mass
246.9494
XLogP
1.69
TPSA
43.09
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
10
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0
Molar refractivity
48.96
Supplementary Information
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