SMILES:
Cc1ccc(I)c(F)n1Molecular Processing
Molecular formula
C6H5FIN
Molecular weight
237.02
Exact mass
236.9451
XLogP
2.13
TPSA
12.89
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
9
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
41.65
Supplementary Information
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