CC(C)(C)C(=O)C[S+]1CCCC1.O=S(=O)([O-])C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
SMILES: CC(C)(C)C(=O)C[S+]1CCCC1.O=S(=O)([O-])C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

Molecular Processing

Molecular formula
C14H19F9O4S2
Molecular weight
486.42
Exact mass
486.0581
XLogP
3.97
TPSA
74.27
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
29
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
15
Covalent units
2
Fraction Csp3
0.929
Molar refractivity
86.26

Supplementary Information

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