SMILES:
COC(=O)c1sc(C(=O)O)cc1C(F)(F)FMolecular Processing
Molecular formula
C8H5F3O4S
Molecular weight
254.18
Exact mass
253.9861
XLogP
2.25
TPSA
63.6
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
47.62
Supplementary Information
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