SMILES:
COc1sccc1BrMolecular Processing
Molecular formula
C5H5BrOS
Molecular weight
193.06
Exact mass
191.9244
XLogP
2.52
TPSA
9.23
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
8
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
38.57
Supplementary Information
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