SMILES:
O=C1CCC2(CC1)CCN(c1ccc(C(O)C(F)(F)F)cc1)C2=OMolecular Processing
Molecular formula
C17H18F3NO3
Molecular weight
341.33
Exact mass
341.1239
XLogP
3.15
TPSA
57.61
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
24
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.529
Molar refractivity
80.33
Supplementary Information
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