SMILES:
CC(=O)c1ccc(Br)cc1ClMolecular Processing
Molecular formula
C8H6BrClO
Molecular weight
233.49
Exact mass
231.9291
XLogP
3.31
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
49.16
Supplementary Information
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