SMILES:
Cc1cc(-c2ccc(Cl)cc2)ccc1C1C(=O)C2CCC(C2)C1=OMolecular Processing
Molecular formula
C21H19ClO2
Molecular weight
338.83
Exact mass
338.1074
XLogP
4.97
TPSA
34.14
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
24
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
95.21
Supplementary Information
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