Name: 1-(6-fluorobenzoxazol-2-yl)-4,4,4-trifluorobutane-1,3-dione
SMILES:
O=C(CC(=O)C(F)(F)F)c1nc2ccc(F)cc2o1Molecular Processing
Molecular formula
C11H5F4NO3
Molecular weight
275.16
Exact mass
275.0206
XLogP
2.67
TPSA
60.17
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
53.98
Supplementary Information
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