SMILES:
Cn1c2cc(Cl)ccc2c(=O)c2c(Br)cccc21Molecular Processing
Molecular formula
C14H9BrClNO
Molecular weight
322.59
Exact mass
320.9556
XLogP
4.11
TPSA
22
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
18
Rings
3
Aromatic rings
3
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
79.41
Supplementary Information
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