SMILES:
Brc1ccc(SC2CCOCC2)cc1Molecular Processing
Molecular formula
C11H13BrOS
Molecular weight
273.19
Exact mass
271.987
XLogP
3.72
TPSA
9.23
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
63.84
Supplementary Information
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