O[C@H]1CCC[C@@H]1c1cc(F)c(F)c(F)c1
名称: (1S,2R)-2-(3,4,5-trifluorophenyl)cyclopentanol
SMILES: O[C@H]1CCC[C@@H]1c1cc(F)c(F)c(F)c1

Molecular Processing

Molecular formula
C11H11F3O
Molecular weight
216.2
Exact mass
216.0762
XLogP
2.73
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
48.91

Supplementary Information

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