CC1(C)C(OCC(F)(F)F)C1C(=O)OCc1ccc(F)c(Oc2ccccc2)c1
SMILES: CC1(C)C(OCC(F)(F)F)C1C(=O)OCc1ccc(F)c(Oc2ccccc2)c1

Molecular Processing

Molecular formula
C21H20F4O4
Molecular weight
412.38
Exact mass
412.1298
XLogP
5.26
TPSA
44.76
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
29
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.381
Molar refractivity
95.78

Supplementary Information

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