SMILES:
N#CC(C#N)Cc1ccc(OC(F)(F)F)cc1Molecular Processing
Molecular formula
C11H7F3N2O
Molecular weight
240.18
Exact mass
240.051
XLogP
2.79
TPSA
56.81
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
51.55
Supplementary Information
Details werden geladen…
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