SMILES:
N#Cc1ccc(OC(F)F)cc1Molecular Processing
Molecular formula
C8H5F2NO
Molecular weight
169.13
Exact mass
169.0339
XLogP
2.16
TPSA
33.02
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
37.79
Supplementary Information
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