SMILES:
N#Cc1ccc2cc(OS(=O)(=O)C(F)(F)F)ccc2c1Molecular Processing
Molecular formula
C12H6F3NO3S
Molecular weight
301.24
Exact mass
301.002
XLogP
2.94
TPSA
67.16
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.083
Molar refractivity
64.27
Supplementary Information
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