SMILES:
COc1cc(Br)c(F)cc1ClMolecular Processing
Molecular formula
C7H5BrClFO
Molecular weight
239.47
Exact mass
237.9196
XLogP
3.25
TPSA
9.23
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
4
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
45.66
Supplementary Information
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