SMILES:
O=C1Nc2ccc(O)cc2C(C#CC2CC2)(C(F)(F)F)O1Molecular Processing
Molecular formula
C14H10F3NO3
Molecular weight
297.23
Exact mass
297.0613
XLogP
3.13
TPSA
58.56
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
21
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
66.44
Supplementary Information
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Involved in 4 reactions→