이름: 3-fluoro-4-nitrophenyl trifluoromethanesulfonate
SMILES:
O=[N+]([O-])c1ccc(OS(=O)(=O)C(F)(F)F)cc1FMolecular Processing
Molecular formula
C7H3F4NO5S
Molecular weight
289.16
Exact mass
288.9668
XLogP
1.96
TPSA
86.51
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
48.66
Supplementary Information
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