O=[N+]([O-])c1ccc(N2CCOCC2)c(C(F)(F)F)c1
SMILES: O=[N+]([O-])c1ccc(N2CCOCC2)c(C(F)(F)F)c1

Molecular Processing

Molecular formula
C11H11F3N2O3
Molecular weight
276.21
Exact mass
276.0722
XLogP
2.45
TPSA
55.61
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
19
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
61.13

Supplementary Information

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