SMILES:
COC(=O)c1c(Cl)cc(-c2ccccc2)cc1ClMolecular Processing
Molecular formula
C14H10Cl2O2
Molecular weight
281.14
Exact mass
280.0058
XLogP
4.45
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.071
Molar refractivity
73.24
Supplementary Information
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