SMILES:
COc1cc(Br)c(I)cc1OCMolecular Processing
Molecular formula
C8H8BrIO2
Molecular weight
342.96
Exact mass
341.8752
XLogP
3.07
TPSA
18.46
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
59.96
Supplementary Information
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