SMILES:
COc1c(C=O)cc(C(=O)O)cc1C(F)(F)FMolecular Processing
Molecular formula
C10H7F3O4
Molecular weight
248.16
Exact mass
248.0296
XLogP
2.22
TPSA
63.6
H-bond donors
1
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
50.34
Supplementary Information
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