SMILES:
O=C1OCCC1Oc1ccc(C(F)(F)F)cc1Molecular Processing
Molecular formula
C11H9F3O3
Molecular weight
246.18
Exact mass
246.0504
XLogP
2.4
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
51.44
Supplementary Information
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