COc1cc(C(C)C)ccc1C(C)C(C)C(O)(CO)C(F)(F)F
SMILES: COc1cc(C(C)C)ccc1C(C)C(C)C(O)(CO)C(F)(F)F

Molecular Processing

Molecular formula
C17H25F3O3
Molecular weight
334.38
Exact mass
334.1756
XLogP
3.84
TPSA
49.69
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
23
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.647
Molar refractivity
82.75

Supplementary Information

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