SMILES:
COCC12C=CC(COC)(CC(OS(=O)(=O)C(F)(F)F)=C1)O2Molecular Processing
Molecular formula
C12H15F3O6S
Molecular weight
344.31
Exact mass
344.0541
XLogP
1.5
TPSA
71.06
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
22
Rings
2
Aromatic rings
0
Saturated rings
0
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
68.2
Supplementary Information
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