SMILES:
O=S(=O)(O)c1ccc(-c2ccc(Br)cc2)cc1Molecular Processing
Molecular formula
C12H9BrO3S
Molecular weight
313.17
Exact mass
311.9456
XLogP
3.36
TPSA
54.37
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
69.39
Supplementary Information
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