SMILES:
O=c1[nH]c2cc(Br)c(Br)cc2[nH]c1=OMolecular Processing
Molecular formula
C8H4Br2N2O2
Molecular weight
319.94
Exact mass
317.864
XLogP
1.74
TPSA
65.72
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
14
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0
Molar refractivity
60.59
Supplementary Information
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