SMILES:
Cc1ccc(Cl)c(Oc2cc(F)cc(C#N)c2)c1FMolecular Processing
Molecular formula
C14H8ClF2NO
Molecular weight
279.67
Exact mass
279.0262
XLogP
4.59
TPSA
33.02
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.071
Molar refractivity
67.34
Supplementary Information
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