Name: intermediate ( 19 )
SMILES:
CC(=O)N1c2ccc(F)cc2CC1C#NMolecular Processing
Molecular formula
C11H9FN2O
Molecular weight
204.2
Exact mass
204.0699
XLogP
1.63
TPSA
44.1
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
52.67
Supplementary Information
Details werden geladen…
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