SMILES:
O=C(Cl)N1CC(Oc2ccc(Cl)c(Cl)c2)C1Molecular Processing
Molecular formula
C10H8Cl3NO2
Molecular weight
280.54
Exact mass
278.9621
XLogP
3.42
TPSA
29.54
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
63.7
Supplementary Information
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