Nombre: 4′-(2,3-Difluoro-4-(4-pentylcylohexyl)phenyl)bi(cyclohexane)-4-ol
SMILES:
CCCCCC1CCC(c2ccc(C3CCC(C4CCC(O)CC4)CC3)c(F)c2F)CC1Molecular Processing
Molecular formula
C29H44F2O
Molecular weight
446.67
Exact mass
446.336
XLogP
8.64
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
7
Heavy atoms
32
Rings
4
Aromatic rings
1
Saturated rings
3
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.793
Molar refractivity
127.86
Supplementary Information
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