SMILES:
O=C(O)c1cc(C(F)(F)F)cc([N+](=O)[O-])c1OMolecular Processing
Molecular formula
C8H4F3NO5
Molecular weight
251.12
Exact mass
251.0042
XLogP
2.02
TPSA
100.67
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
46.72
Supplementary Information
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