الاسم: 4-[5-fluoro-2-(trifluoromethyl)phenyl]-4-{[4-(trifluoromethyl)phenyl]sulfonyl}cyclohexanol
SMILES:
O=S(=O)(c1ccc(C(F)(F)F)cc1)C1(c2cc(F)ccc2C(F)(F)F)CCC(O)CC1Molecular Processing
Molecular formula
C20H17F7O3S
Molecular weight
470.41
Exact mass
470.0787
XLogP
5.47
TPSA
54.37
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
31
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
96.18
Supplementary Information
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