SMILES:
CC(=Cc1cccc(OC(F)(F)F)c1)[N+](=O)[O-]Molecular Processing
Molecular formula
C10H8F3NO3
Molecular weight
247.17
Exact mass
247.0456
XLogP
3.22
TPSA
52.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
17
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
0.2
Molar refractivity
53.77
Supplementary Information
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