SMILES:
O=C(O)c1cc(I)ccc1BrMolecular Processing
Molecular formula
C7H4BrIO2
Molecular weight
326.91
Exact mass
325.8439
XLogP
2.75
TPSA
37.3
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
11
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
Molar refractivity
53.82
Supplementary Information
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