SMILES:
O=[N+]([O-])c1cccc2cc(CBr)oc12Molecular Processing
Molecular formula
C9H6BrNO3
Molecular weight
256.05
Exact mass
254.9531
XLogP
3.24
TPSA
56.28
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
55.5
Supplementary Information
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