CC1(C)CC(c2cccc(C(F)(F)F)c2)c2ccc(O)cc2O1
SMILES: CC1(C)CC(c2cccc(C(F)(F)F)c2)c2ccc(O)cc2O1

Molecular Processing

Molecular formula
C18H17F3O2
Molecular weight
322.33
Exact mass
322.1181
XLogP
5.1
TPSA
29.46
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
80.72

Supplementary Information

Details werden geladen…

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