CCC(C)Oc1c(F)c(F)c(C#N)c(F)c1C#N
SMILES: CCC(C)Oc1c(F)c(F)c(C#N)c(F)c1C#N

Molecular Processing

Molecular formula
C12H9F3N2O
Molecular weight
254.21
Exact mass
254.0667
XLogP
3.02
TPSA
56.81
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
56.13

Supplementary Information

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