Nombre: 5-iodo-2,3,4-trifluoro-1-[trans-4-(trans-4-propylcyclohexyl)cyclohexyl]benzene
SMILES:
CCC[C@H]1CC[C@H]([C@H]2CC[C@H](c3cc(I)c(F)c(F)c3F)CC2)CC1Molecular Processing
Molecular formula
C21H28F3I
Molecular weight
464.35
Exact mass
464.1188
XLogP
7.59
TPSA
0
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
4
Heavy atoms
25
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
104.09
Supplementary Information
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