SMILES:
COc1ccc([N+](=O)[O-])cc1C(F)(F)FMolecular Processing
Molecular formula
C8H6F3NO3
Molecular weight
221.13
Exact mass
221.03
XLogP
2.62
TPSA
52.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
44.65
Supplementary Information
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