SMILES:
O=C(Cl)c1cc(Br)cnc1ClMolecular Processing
Molecular formula
C6H2BrCl2NO
Molecular weight
254.9
Exact mass
252.8697
XLogP
2.88
TPSA
29.96
H-bond donors
0
H-bond acceptors
2
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
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
47.13
Supplementary Information
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