CC(C)(C)Oc1ccc(C(F)(F)F)cc1CN
SMILES: CC(C)(C)Oc1ccc(C(F)(F)F)cc1CN

Molecular Processing

Molecular formula
C12H16F3NO
Molecular weight
247.26
Exact mass
247.1184
XLogP
3.34
TPSA
35.25
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
59.72

Supplementary Information

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