Name: 1,5-bis[p-(trifluoromethoxy)phenyl]-1,4-pentadien-3-one
SMILES:
O=C(C=Cc1ccc(OC(F)(F)F)cc1)C=Cc1ccc(OC(F)(F)F)cc1Molecular Processing
Molecular formula
C19H12F6O3
Molecular weight
402.29
Exact mass
402.0691
XLogP
5.78
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
28
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.105
Molar refractivity
89.33
Supplementary Information
Details werden geladen…
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