FC(F)(F)/C(Cl)=C/COCCCCOc1c(Cl)cc(OCC=C(Cl)Cl)cc1Cl
SMILES: FC(F)(F)/C(Cl)=C/COCCCCOc1c(Cl)cc(OCC=C(Cl)Cl)cc1Cl

Molecular Processing

Molecular formula
C17H16Cl5F3O3
Molecular weight
502.57
Exact mass
499.9494
XLogP
7.55
TPSA
27.69
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
11
Heavy atoms
28
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
107.29

Supplementary Information

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