SMILES:
OCc1cc(I)ccc1OCc1ccccc1Molecular Processing
Molecular formula
C14H13IO2
Molecular weight
340.16
Exact mass
339.996
XLogP
3.36
TPSA
29.46
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
75.86
Supplementary Information
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