SMILES:
COc1ccc(CC(Cl)(c2ccccc2)c2ccccc2)cc1Molecular Processing
Molecular formula
C21H19ClO
Molecular weight
322.84
Exact mass
322.1124
XLogP
5.42
TPSA
9.23
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
5
Heavy atoms
23
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
96.22
Supplementary Information
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