SMILES:
COC(=O)C(F)(F)c1ccc2ncccc2c1Molecular Processing
Molecular formula
C12H9F2NO2
Molecular weight
237.21
Exact mass
237.0601
XLogP
2.5
TPSA
39.19
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
57.65
Supplementary Information
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