Name: 3-[(2,5-difluorophenyl)[[3-(1,1,2,2-tetrafluoroethoxy)phenyl]methyl]amino]-1,1,1-trifluoro-2-propanol
SMILES:
OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cc(F)ccc1F)C(F)(F)FMolecular Processing
Molecular formula
C18H14F9NO2
Molecular weight
447.3
Exact mass
447.0881
XLogP
5.13
TPSA
32.7
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
30
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
87.49
Supplementary Information
Details werden geladen…
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