Cc1ccc(S(=O)(=O)OCCc2ccccc2Br)cc1
SMILES: Cc1ccc(S(=O)(=O)OCCc2ccccc2Br)cc1

Molecular Processing

Molecular formula
C15H15BrO3S
Molecular weight
355.25
Exact mass
353.9925
XLogP
3.71
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
20
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
0.2
Molar refractivity
82.16

Supplementary Information

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