SMILES:
O=C(O)c1ccc(N(CCO)CCO)c(C(F)(F)F)c1Molecular Processing
Molecular formula
C12H14F3NO4
Molecular weight
293.24
Exact mass
293.0875
XLogP
1.19
TPSA
81
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
20
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
64.79
Supplementary Information
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