SMILES:
O=S(=O)([O-])C(F)(F)F.OCc1cc[n+](CCS)cc1Molecular Processing
Molecular formula
C9H12F3NO4S2
Molecular weight
319.33
Exact mass
319.016
XLogP
0.45
TPSA
81.31
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
2
Fraction Csp3
0.444
Molar refractivity
62.17
Supplementary Information
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